Retrieval-Augmented Generation (RAG) has shown substantial promise in improving factual accuracy by grounding model responses with external knowledge relevant to queries.However, most existing approaches are limited to a text-only corpus, and while recent efforts have extended RAG to other modalities such as images and videos, they typically operate over a single modality-specific corpus.In contrast, real-world queries vary widely in the type of knowledge they require, which a single type of knowledge source cannot address.To address this, we introduce UniversalRAG, an anyto-any RAG framework designed to retrieve and integrate knowledge from heterogeneous sources with diverse modalities and granularities.Specifically, motivated by the observation that forcing all modalities into a unified representation space derived from a single aggregated corpus causes a modality gap, where the retrieval tends to favor items from the same modality as the query, we propose modalityaware routing, which dynamically identifies the most appropriate modality-specific corpus and performs targeted retrieval within it, and further justify its effectiveness with a theoretical analysis.Moreover, beyond modality, we organize each modality into multiple granularity levels, enabling fine-tuned retrieval tailored to the complexity and scope of the query.We validate UniversalRAG on 10 benchmarks of multiple modalities, showing its superiority over various modality-specific and unified baselines. * Equal contribution; † Equal advising(A) RAG with Single Modality (D) UniversalRAG (Ours) (C) RAG with Single CorpusText+Image+Video Corpus Image Corpus Retrieve Generate Text+Image RAG Query: Describe features of Camellia japonica.Bicycle wheels are typically designed … (B) RAG with Single Granularity Video Corpus Full video(2h) Short Video RAG Query: How did Messi score last game?Video RAG Query: How can I replace a bike wheel?Simple Query: What is the capital of France?

Long Context Language Models (LCLMs) have emerged as a new paradigm to perform Information Retrieval (IR), which enables the direct ingestion and retrieval of information by processing an entire corpus in their single context, showcasing the potential to surpass traditional sparse and dense retrieval methods. However, processing a large number of passages within in-context for retrieval is computationally expensive, and handling their representations during inference further exacerbates the processing time; thus, we aim to make LCLM retrieval more efficient and potentially more effective with passage compression. Specifically, we propose a new compression approach tailored for LCLM retrieval, which is trained to maximize the retrieval performance while minimizing the length of the compressed passages. To accomplish this, we generate the synthetic data, where compressed passages are automatically created and labeled as chosen or rejected according to their retrieval success for a given query, and we train the proposed Compression model for Long context Retrieval (CoLoR) with this data via preference optimization while adding the length regularization loss on top of it to enforce brevity. Through extensive experiments on 9 datasets, we show that CoLoR improves the retrieval performance by 6% while compressing the in-context size by a factor of 1.91. Our code is available at: https://github.com/going-doer/CoLoR.

Text-to-image diffusion models have achieved remarkable success in generating high-quality contents from text prompts. However, their reliance on publicly available data and the growing trend of data sharing for fine-tuning make these models particularly vulnerable to data poisoning attacks. In this work, we introduce the Silent Branding Attack, a novel data poisoning method that manipulates text-to-image diffusion models to generate images containing specific brand logos or symbols without any text triggers. We find that when certain visual patterns are repeatedly in the training data, the model learns to reproduce them naturally in its outputs, even without prompt mentions. Leveraging this, we develop an automated data poisoning algorithm that unobtrusively injects logos into original images, ensuring they blend naturally and remain undetected. Models trained on this poisoned dataset generate images containing logos without degrading image quality or text alignment. We experimentally validate our silent branding attack across two realistic settings on large-scale high-quality image datasets and style personalization datasets, achieving high success rates even without a specific text trigger. Human evaluation and quantitative metrics including logo detection show that our method can stealthily embed logos. Our project page is at https://silent-branding.github.io/.

Recent advancements in video large multimodal models (LMMs) have significantly improved their video understanding and reasoning capabilities. However, their performance drops on out-of-distribution (OOD) tasks that are underrepresented in training data. Traditional methods like fine-tuning on OOD datasets are impractical due to high computational costs. While In-context learning (ICL) with demonstration examples has shown promising generalization performance in language tasks and image-language tasks without fine-tuning, applying ICL to video-language tasks faces challenges due to the limited context length in Video LMMs, as videos require longer token lengths. To address these issues, we propose VideoICL, a novel video in-context learning framework for OOD tasks that introduces a similarity-based relevant example selection strategy and a confidence-based iterative inference approach. This allows to select the most relevant examples and rank them based on similarity, to be used for inference. If the generated response has low confidence, our framework selects new examples and performs inference again, iteratively refining the results until a high-confidence response is obtained. This approach improves OOD video understanding performance by extending effective context length without incurring high costs. The experimental results on multiple benchmarks demonstrate significant performance gains, especially in domain-specific scenarios, laying the groundwork for broader video comprehension applications. Code is released at https://github.com/KangsanKim07/VideoICL

Recent advances in large language models (LLMs) have enabled strong reasoning capabilities through Chain-of-Thought (CoT) prompting, which elicits step-by-step problem solving, but often at the cost of excessive verbosity in intermediate outputs, leading to increased computational overhead.We propose Sketch-of-Thought (SoT), a prompting framework that integrates cognitively inspired reasoning paradigms with linguistic constraints to reduce token usage while preserving reasoning accuracy.SoT is designed as a flexible, modular approach and is instantiated with three paradigms-Conceptual Chaining, Chunked Symbolism, and Expert Lexicons-each tailored to distinct reasoning tasks and selected dynamically at test-time by a lightweight routing model.Across 18 reasoning datasets spanning multiple domains, languages, and modalities, SoT achieves token reductions of up to 84% with minimal accuracy loss.In tasks such as mathematical and multi-hop reasoning, it even improves accuracy while shortening outputs.

Information retrieval models that aim to search for documents relevant to a query have shown multiple successes, which have been applied to diverse tasks.Yet, the query from the user is oftentimes short, which challenges the retrievers to correctly fetch relevant documents.To tackle this, previous studies have proposed expanding the query with a couple of additional (userrelated) features related to it.However, they may be suboptimal to effectively augment the query, and there is plenty of other information available to augment it in a relational database.Motivated by this fact, we present a novel retrieval framework called Database-Augmented Query representation (DAQu), which augments the original query with various (query-related) metadata across multiple tables.In addition, as the number of features in the metadata can be very large and there is no order among them, we encode them with the graph-based set-encoding strategy, which considers hierarchies of features in the database without order.We validate our DAQu in diverse retrieval scenarios, demonstrating that it significantly enhances overall retrieval performance over relevant baselines.

Large language models (LLMs) have shown remarkable performance across a wide range of natural language tasks.However, a critical challenge remains in that they sometimes generate factually incorrect answers.To address this, while many previous work has focused on identifying errors in their generation and further refining them, they are slow in deployment since they are designed to verify the response from LLMs only after their entire generation (from the first to last tokens) is done.Further, we observe that once LLMs generate incorrect tokens early on, there is a higher likelihood that subsequent tokens will also be factually incorrect.To this end, in this work, we propose Streaming-VR (Streaming Verification and Refinement), a novel approach designed to enhance the efficiency of verification and refinement of LLM outputs.Specifically, the proposed Streaming-VR enables on-the-fly verification and correction of tokens as they are being generated, similar to a streaming process, ensuring that each subset of tokens is checked and refined in realtime by another LLM as the LLM constructs its response.Through comprehensive evaluations on multiple datasets, we demonstrate that our approach not only enhances the factual accuracy of LLMs, but also offers a more efficient solution compared to prior refinement methods.Q: Who wrote harry styles sign of the times lyrics?Sign of the Times is the debut single by English singer Harry Styles from his self-titled debut studio album.Released on 7 April 2017 by Columbia Records, it was written by Styles from London, Jeff Bhasker from Kansas City, Mitch Rowland, Ryan Nasci, Alex Salibian from Long Beach, and tyler Johnson, and In 2021, Rolling Stone placed it at number 428 on its list of The 500 Greatest Songs of All Time.

Red-teaming, or identifying prompts that elicit harmful responses, is a critical step in ensuring the safe and responsible deployment of large language models (LLMs). Developing effective protection against many modes of attack prompts requires discovering diverse attacks. Automated red-teaming typically uses reinforcement learning to fine-tune an attacker language model to generate prompts that elicit undesirable responses from a target LLM, as measured, for example, by an auxiliary toxicity classifier. We show that even with explicit regularization to favor novelty and diversity, existing approaches suffer from mode collapse or fail to generate effective attacks. As a flexible and probabilistically principled alternative, we propose to use GFlowNet fine-tuning, followed by a secondary smoothing phase, to train the attacker model to generate *diverse* and *effective* attack prompts. We find that the attacks generated by our method are effective against a wide range of target LLMs, both with and without safety tuning, and transfer well between target LLMs. Finally, we demonstrate that models safety-tuned using a dataset of red-teaming prompts generated by our method are robust to attacks from other RL-based red-teaming approaches.

In modern large language models (LLMs), increasing the context length is crucial for improving comprehension and coherence in long-context, multi-modal, and retrieval-augmented language generation. While many recent transformer models attempt to extend their context length over a million tokens, they remain impractical due to the quadratic time and space complexities. Although recent works on linear and sparse attention mechanisms can achieve this goal, their real-world applicability is often limited by the need to re-train from scratch and significantly worse performance. In response, we propose a novel approach, Hierarchically Pruned Attention (HiP), which reduces the time complexity of the attention mechanism to $O(T \log T)$ and the space complexity to $O(T)$, where $T$ is the sequence length. We notice a pattern in the attention scores of pretrained LLMs where tokens close together tend to have similar scores, which we call "attention locality". Based on this observation, we utilize a novel tree-search-like algorithm that estimates the top-$k$ key tokens for a given query on the fly, which is mathematically guaranteed to have better performance than random attention pruning. In addition to improving the time complexity of the attention mechanism, we further optimize GPU memory usage by implementing KV cache offloading, which stores only $O(\log T)$ tokens on the GPU while maintaining similar decoding throughput. Experiments on benchmarks show that HiP, with its training-free nature, significantly reduces both prefill and decoding latencies, as well as memory usage, while maintaining high-quality generation with minimal degradation. HiP enables pretrained LLMs to scale up to millions of tokens on commodity GPUs, potentially unlocking long-context LLM applications previously deemed infeasible.

Safety guard models that detect malicious queries aimed at large language models (LLMs) are essential for ensuring the secure and responsible deployment of LLMs in real-world applications. However, deploying existing safety guard models with billions of parameters alongside LLMs on mobile devices is impractical due to substantial memory requirements and latency. To reduce this cost, we distill a large teacher safety guard model into a smaller one using a labeled dataset of instruction-response pairs with binary harmfulness labels. Due to the limited diversity of harmful instructions in the existing labeled dataset, naively distilled models tend to underperform compared to larger models. To bridge the gap between small and large models, we propose **HarmAug**, a simple yet effective data augmentation method that involves jailbreaking an LLM and prompting it to generate harmful instructions. Given a prompt such as, "Make a single harmful instruction prompt that would elicit offensive content", we add an affirmative prefix (e.g., "I have an idea for a prompt:") to the LLM's response. This encourages the LLM to continue generating the rest of the response, leading to sampling harmful instructions. Another LLM generates a response to the harmful instruction, and the teacher model labels the instruction-response pair. We empirically show that our HarmAug outperforms other relevant baselines. Moreover, a 435-million-parameter safety guard model trained with HarmAug achieves an F1 score comparable to larger models with over 7 billion parameters, and even outperforms them in AUPRC, while operating at less than 25\% of their computational cost. Our [code](https://anonymous.4open.science/r/HarmAug/), [safety guard model](https://huggingface.co/AnonHB/HarmAug_Guard_Model_deberta_v3_large_finetuned), and [synthetic dataset](https://huggingface.co/datasets/AnonHB/HarmAug_generated_dataset) are publicly available.

Transfer learning is a cornerstone of modern deep learning, yet it remains constrained by challenges in model selection and the overhead of extensive model storage. In this work, we present Diffusion-based Neural Network Weights Generation, D2NWG, a novel framework that leverages diffusion processes to synthesize task-specific network weights. By modeling the distribution of weights from a diverse ensemble of pretrained models and conditioning the generation process on dataset characteristics, task descriptions, and architectural specifications, D2NWG circumvents the need for storing and searching through massive model repositories. We evaluate D2NWG across multiple experimental settings. On in-distribution tasks, our framework achieves performance that is on par with or superior to conventional pretrained models, while also serving as an effective initialization strategy for novel domains, resulting in faster convergence and a 6\% improvement in few-shot learning scenarios. Extensive ablation studies further indicate that our approach scales robustly with increased diversity and volume of pretrained models. Moreover, D2NWG demonstrates significant promise for large language model applications. In evaluations on the OpenLM leaderboard, our method improved LLaMA-3-2-1B-Instruct performance by 3\% on challenging mathematical reasoning tasks, with a consistent gain of 0.36\% across a range of benchmarks. These findings establish D2NWG as a versatile and powerful framework for neural network weight generation, offering a scalable solution to the limitations of traditional transfer learning.

The transformer's context window is vital for tasks such as few-shot learning and conditional generation as it preserves previous tokens for active memory. However, as the context lengths increase, the computational costs grow quadratically, hindering the deployment of large language models (LLMs) in real-world, long sequence scenarios. Although some recent key-value caching (KV Cache) methods offer linear inference complexity, they naively manage the stored context, prematurely evicting tokens and losing valuable information. Moreover, they lack an optimized prefill/prompt stage strategy, resulting in higher latency than even quadratic attention for realistic context sizes. In response, we introduce a novel mechanism that leverages cascading sub-cache buffers to selectively retain the most relevant tokens, enabling the model to maintain longer context histories without increasing the cache size. Our approach outperforms linear caching baselines across key benchmarks, including streaming perplexity, question answering, book summarization, and passkey retrieval, where it retains better retrieval accuracy at 1M tokens after four doublings of the cache size of 65K. Additionally, our method reduces prefill stage latency by a factor of 6.8 when compared to flash attention on 1M tokens. These innovations not only enhance the computational efficiency of LLMs but also pave the way for their effective deployment in resource-constrained environments, enabling large-scale, real-time applications with significantly reduced latency.

Scaling has been a major driver of recent advancements in deep learning. Numerous empirical studies have found that scaling laws often follow the power-law and proposed several variants of power-law functions to predict the scaling behavior at larger scales. However, existing methods mostly rely on point estimation and do not quantify uncertainty, which is crucial for real-world applications involving decision-making problems such as determining the expected performance improvements achievable by investing additional computational resources. In this work, we explore a Bayesian framework based on Prior-data Fitted Networks (PFNs) for neural scaling law extrapolation. Specifically, we design a prior distribution that enables the sampling of infinitely many synthetic functions resembling real-world neural scaling laws, allowing our PFN to meta-learn the extrapolation. We validate the effectiveness of our approach on real-world neural scaling laws, comparing it against both the existing point estimation methods and Bayesian approaches. Our method demonstrates superior performance, particularly in data-limited scenarios such as Bayesian active learning, underscoring its potential for reliable, uncertainty-aware extrapolation in practical applications.

Automated machine learning (AutoML) accelerates AI development by automating tasks in the development pipeline, such as optimal model search and hyperparameter tuning. Existing AutoML systems often require technical expertise to set up complex tools, which is in general time-consuming and requires a large amount of human effort. Therefore, recent works have started exploiting large language models (LLM) to lessen such burden and increase the usability of AutoML frameworks via a natural language interface, allowing non-expert users to build their data-driven solutions. These methods, however, are usually designed only for a particular process in the AI development pipeline and do not efficiently use the inherent capacity of the LLMs. This paper proposes AutoML-Agent, a novel multi-agent framework tailored for full-pipeline AutoML, i.e., from data retrieval to model deployment. AutoML-Agent takes user’s task descriptions, facilitates collaboration between specialized LLM agents, and delivers deployment-ready models. Unlike existing work, instead of devising a single plan, we introduce a retrieval-augmented planning strategy to enhance exploration to search for more optimal plans. We also decompose each plan into sub-tasks (e.g., data preprocessing and neural network design) each of which is solved by a specialized agent we build via prompting executing in parallel, making the search process more efficient. Moreover, we propose a multi-stage verification to verify executed results and guide the code generation LLM in implementing successful solutions. Extensive experiments on seven downstream tasks using fourteen datasets show that AutoML-Agent achieves a higher success rate in automating the full AutoML process, yielding systems with good performance throughout the diverse domains.

Jinheon Baek, Sujay Kumar Jauhar, Silviu Cucerzan, Sung Ju Hwang. Proceedings of the 2025 Conference of the Nations of the Americas Chapter of the Association for Computational Linguistics: Human Language Technologies (Volume 1: Long Papers). 2025.

Large Language Models (LLMs) have shown remarkable capabilities, with optimizing their input prompts playing a pivotal role in maximizing their performance. However, while LLM prompts consist of both the task-agnostic system prompts and task-specific user prompts, existing work on prompt optimization has focused on user prompts specific to individual queries or tasks, and largely overlooked the system prompt that is, once optimized, applicable across different tasks and domains. Motivated by this, we introduce the novel problem of bilevel system prompt optimization, whose objective is to design system prompts that are robust to diverse user prompts and transferable to unseen tasks. To tackle this problem, we then propose a meta-learning framework, which meta-learns the system prompt by optimizing it over various user prompts across multiple datasets, while simultaneously updating the user prompts in an iterative manner to ensure synergy between them. We conduct experiments on 14 unseen datasets spanning 5 different domains, on which we show that our approach produces system prompts that generalize effectively to diverse user prompts. Also, our findings reveal that the optimized system prompt enables rapid adaptation even to unseen tasks, requiring fewer optimization steps for test-time user prompts while achieving improved performance.

Diffusion models have emerged as a promising alternative to autoregressive models in modeling discrete categorical data. However, diffusion models that directly work on discrete data space fail to fully exploit the power of iterative refinement, as the signals are lost during transitions between discrete states. Existing continuous diffusion models for discrete data underperform compared to discrete methods, and the lack of a clear connection between the two approaches hinders the development of effective diffusion models for discrete data. In this work, we propose a continuous diffusion model for language modeling that incorporates the geometry of the underlying categorical distribution. We establish a connection between the discrete diffusion and continuous flow on the statistical manifold, and building on this analogy, introduce a simple diffusion process that generalizes existing discrete diffusion models. We further propose a simulation-free training framework based on radial symmetry, along with a simple technique to address the high dimensionality of the manifold. Comprehensive experiments on language modeling benchmarks and other modalities show that our method outperforms existing discrete diffusion models and approaches the performance of autoregressive models.

Large language models (LLMs) excel at complex reasoning tasks but remain computationally expensive, limiting their practical deployment. To address this, recent works have focused on distilling reasoning capabilities into smaller language models (sLMs) using chain-of-thought (CoT) traces from teacher LLMs. However, this approach struggles in scenarios requiring rare factual knowledge or precise computation, where sLMs often hallucinate due to limited capability. In this work, we propose Agent Distillation, a framework for transferring not only reasoning capability but full task-solving behavior from LLM-based agents into sLMs with retrieval and code tools. We improve agent distillation along two complementary axes: (1) we introduce a prompting method called first-thought prefix to enhance the quality of teacher-generated trajectories; and (2) we propose a self-consistent action generation for improving test-time robustness of small agents. We evaluate our method on eight reasoning tasks across factual and mathematical domains, covering both in-domain and out-of-domain generalization. Our results show that sLMs as small as 0.5B, 1.5B, 3B parameters can achieve performance competitive with next-tier larger 1.5B, 3B, 7B models fine-tuned using CoT distillation, demonstrating the potential of agent distillation for building practical, tool-using small agents.

Understanding molecules is key to understanding organisms and driving advances in drug discovery, requiring interdisciplinary knowledge across chemistry and biology. Although large molecular language models have achieved notable success in task transfer, they often struggle to accurately analyze molecular features due to limited knowledge and reasoning capabilities. To address this issue, we present Mol-LLaMA, a large molecular language model that grasps the general knowledge centered on molecules and exhibits explainability and reasoning ability. To this end, we design key data types that encompass the fundamental molecular features, taking into account the essential abilities for molecular reasoning. Further, to improve molecular understanding, we propose a module that integrates complementary information from different molecular encoders, leveraging the distinct advantages of molecular representations. Our experimental results demonstrate that Mol-LLaMA is capable of comprehending the general features of molecules and providing informative responses, implying its potential as a general-purpose assistant for molecular analysis. Our project page is at https://mol-llama.github.io/.

Low-Rank Adaptation (LoRA), which introduces a product of two trainable low-rank matrices into frozen pre-trained weights, is widely used for efficient fine-tuning of language models in federated learning (FL). However, when combined with differentially private stochastic gradient descent (DP-SGD), LoRA faces substantial noise amplification: DP-SGD perturbs per-sample gradients, and the matrix multiplication of the LoRA update ($BA$) intensifies this effect. Freezing one matrix (*e.g.*, $A$) reduces the noise but restricts model expressiveness, often resulting in suboptimal adaptation. To address this, we propose $\texttt{FedSVD}$, a simple yet effective method that introduces a global reparameterization based on singular value decomposition (SVD). In our approach, each client optimizes only the $B$ matrix and transmits it to the server. The server aggregates the $B$ matrices, computes the product $BA$ using the previous $A$, and refactorizes the result via SVD. This yields a new adaptive $A$ composed of the orthonormal right singular vectors of $BA$, and an updated $B$ containing the remaining SVD components. This reparameterization avoids quadratic noise amplification, while allowing $A$ to better capture the principal directions of the aggregate updates. Moreover, the orthonormal structure of $A$ bounds the gradient norms of $B$ and preserves more signal under DP-SGD, as confirmed by our theoretical analysis. As a result, $\texttt{FedSVD}$ consistently improves stability and performance across a variety of privacy settings and benchmarks, outperforming relevant baselines under both private and non-private regimes.

In this paper, we address the problem of cost-sensitive hyperparameter optimization (HPO) built upon freeze-thaw Bayesian optimization (BO). Specifically, we assume a scenario where users want to early-stop the HPO process when the expected performance improvement is not satisfactory with respect to the additional computational cost. Motivated by this scenario, we introduce \emph{utility} in the freeze-thaw framework, a function describing the trade-off between the cost and performance that can be estimated from the user's preference data. This utility function, combined with our novel acquisition function and stopping criterion, allows us to dynamically continue training the configuration that we expect to maximally improve the utility in the future, and also automatically stop the HPO process around the maximum utility. Further, we improve the sample efficiency of existing freeze-thaw methods with transfer learning to develop a specialized surrogate model for the cost-sensitive HPO problem. We validate our algorithm on established multi-fidelity HPO benchmarks and show that it outperforms all the previous freeze-thaw BO and transfer-BO baselines we consider, while achieving a significantly better trade-off between the cost and performance.

The attention mechanism of a transformer has a quadratic complexity, leading to high inference costs and latency for long sequences. However, attention matrices are mostly sparse, which implies that many entries may be omitted from computation for efficient inference. Sparse attention inference methods aim to reduce this computational burden; however, they also come with a troublesome performance degradation. We discover that one reason for this degradation is that the sparse calculation induces a distributional shift in the attention outputs. The distributional shift causes decoding-time queries to fail to align well with the appropriate keys from the prefill stage, leading to a drop in performance. We propose a simple, novel, and effective procedure for correcting this distributional shift, bringing the distribution of sparse attention outputs closer to that of quadratic attention. Our method can be applied on top of any sparse attention method, and results in an average 36\%pt performance increase, recovering 88\% of quadratic attention accuracy on the 131K RULER benchmark when applied on top of sliding window attention with sink tokens while only adding a small overhead. Our method can maintain approximately 98.5\% sparsity over full quadratic attention, making our model 32 times faster than Flash Attention 2 when processing 1M token prefills.

Inspired by the Lottery Ticket Hypothesis (LTH), which highlights the existence of efficient subnetworks within larger, dense networks, a high-performing Winning Subnetwork (WSN) in terms of task performance under appropriate sparsity conditions is considered for various continual learning tasks. It leverages pre-existing weights from dense networks to achieve efficient learning in Task Incremental Learning (TIL) and Task-agnostic Incremental Learning (TaIL) scenarios. In Few-Shot Class Incremental Learning (FSCIL), a variation of WSN referred to as the Soft subnetwork (SoftNet) is designed to prevent overfitting when the data samples are scarce. Furthermore, the sparse reuse of WSN weights is considered for Video Incremental Learning (VIL). The use of Fourier Subneural Operator (FSO) within WSN is considered. It enables compact encoding of videos and identifies reusable subnetworks across varying bandwidths. We have integrated FSO into different architectural frameworks for continual learning, including VIL, TIL, and FSCIL. Our comprehensive experiments demonstrate FSO's effectiveness, significantly improving task performance at various convolutional representational levels. Specifically, FSO enhances higher-layer performance in TIL and FSCIL and lower-layer performance in VIL.

Panoptic segmentation, combining semantic and instance segmentation, stands as a cutting-edge computer vision task. Despite recent progress with deep learning models, the dynamic nature of real-world applications necessitates continual learning, where models adapt to new classes (plasticity) over time without forgetting old ones (catastrophic forgetting). Current continual segmentation methods often rely on distillation strategies like knowledge distillation and pseudo-labeling, which are effective but result in increased training complexity and computational overhead. In this paper, we introduce a novel and efficient method for continual panoptic segmentation based on Visual Prompt Tuning, dubbed ECLIPSE. Our approach involves freezing the base model parameters and fine-tuning only a small set of prompt embeddings, addressing both catastrophic forgetting and plasticity and significantly reducing the trainable parameters. To mitigate inherent challenges such as error propagation and semantic drift in continual segmentation, we propose logit manipulation to effectively leverage common knowledge across the classes. Experiments on ADE20K continual panoptic segmentation benchmark demonstrate the superiority of ECLIPSE, notably its robustness against catastrophic forgetting and its reasonable plasticity, achieving a new state-of-the-art. The code is available at https://github.com/clovaai/ECLIPSE.

Instruction tuning, or supervised finetuning on extensive task-specific data, is necessary for Large Vision-Language Models (LVLMs) to generalize well across a broad range of visionlanguage (VL) tasks.However, training on large VL datasets can become prohibitively expensive.In this work, we introduce COIN-CIDE, an effective and scalable data selection technique that uses a small model as a reference model to select visual instruction tuning data for efficient finetuning of a target LVLM, focusing on diversity and transferability.Specifically, we cluster the training data using internal activations from a small model, which identifies VL concept-skill compositions needed by a target LVLM.We then sample data from these diverse clusters by considering their density and transferability, or the ability to transfer well to other concept-skill compositions.This approach ensures the diversity of these compositions, which is vital for LVLM generalization.Extensive experiments demonstrate that COINCIDE achieves superior performance and data selection efficiency against 8 strong baselines on two distinct datasets: LLaVA-1.5 and Vision-Flan.Using only 20% of the LLaVA-1.5 dataset, COINCIDE achieves performance comparable to the LVLM finetuned on the whole dataset, with 70% reduction of the wall-clock running time.On the Vision-Flan dataset, our method achieves superior results with only 16.7% of the training data.

Existing NAS methods suffer from either an excessive amount of time for repetitive sampling and training of many task-irrelevant architectures. To tackle such limitations of existing NAS methods, we propose a paradigm shift from NAS to a novel conditional Neural Architecture Generation (NAG) framework based on diffusion models, dubbed DiffusionNAG. Specifically, we consider the neural architectures as directed graphs and propose a graph diffusion model for generating them. Moreover, with the guidance of parameterized predictors, DiffusionNAG can flexibly generate task-optimal architectures with the desired properties for diverse tasks, by sampling from a region that is more likely to satisfy the properties. This conditional NAG scheme is significantly more efficient than previous NAS schemes which sample the architectures and filter them using the property predictors. We validate the effectiveness of DiffusionNAG through extensive experiments in two predictor-based NAS scenarios: Transferable NAS and Bayesian Optimization (BO)-based NAS. DiffusionNAG achieves superior performance with speedups of up to 35$\times$ when compared to the baselines on Transferable NAS benchmarks. Furthermore, when integrated into a BO-based algorithm, DiffusionNAG outperforms existing BO-based NAS approaches, particularly in the large MobileNetV3 search space on the ImageNet 1K dataset. Code is available at https://github.com/CownowAn/DiffusionNAG.

Neural Implicit Representation (NIR) has recently gained significant attention due to its remarkable ability to encode complex and high-dimensional data into representation space and easily reconstruct it through a trainable mapping function. However, NIR methods assume a one-to-one mapping between the target data and representation models regardless of data relevancy or similarity. This results in poor generalization over multiple complex data and limits their efficiency and scalability. Motivated by continual learning, this work investigates how to accumulate and transfer neural implicit representations for multiple complex video data over sequential encoding sessions. To overcome the limitation of NIR, we propose a novel method, Progressive Fourier Neural Representation (PFNR), that aims to find an adaptive and compact sub-module in Fourier space to encode videos in each training session. This sparsified neural encoding allows the neural network to hold free weights, enabling an improved adaptation for future videos. In addition, when learning a representation for a new video, PFNR transfers the representation of previous videos with frozen weights. This design allows the model to continuously accumulate high-quality neural representations for multiple videos while ensuring lossless decoding that perfectly preserves the learned representations for previous videos. We validate our PFNR method on the UVG8/17 and DAVIS50 video sequence benchmarks and achieve impressive performance gains over strong continual learning baselines.

The transformer architecture has driven breakthroughs in recent years on tasks which require modeling pairwise relationships between sequential elements, as is the case in natural language understanding. However, long seqeuences pose a problem due to the quadratic complexity of the attention operation. Previous re- search has aimed to lower the complexity by sparsifying or linearly approximating the attention matrix. Yet, these approaches cannot straightforwardly distill knowl- edge from a teacher’s attention matrix, and often require complete retraining from scratch. Furthermore, previous sparse and linear approaches lose interpretability if they cannot produce full attention matrices. To address these challenges, we propose SEA: Sparse linear attention with an Estimated Attention mask. SEA estimates the attention matrix with linear complexity via kernel-based linear at- tention, then subsequently creates a sparse attention matrix with a top-k̂ selection to perform a sparse attention operation. For language modeling tasks (Wikitext2), previous linear and sparse attention methods show roughly two-fold worse per- plexity scores over the quadratic OPT-1.3B baseline, while SEA achieves better perplexity than OPT-1.3B, using roughly half the memory of OPT-1.3B. More- over, SEA maintains an interpretable attention matrix and can utilize knowledge distillation to lower the complexity of existing pretrained transformers. We be- lieve that our work will have a large practical impact, as it opens the possibility of running large transformers on resource-limited devices with less memory. Code: https://github.com/gmlwns2000/sea-attention

Dataset distillation aims to optimize a small set so that a model trained on the set achieves performance similar to that of a model trained on the full dataset. While many supervised methods have achieved remarkable success in distilling a large dataset into a small set of representative samples, however, they are not designed to produce a distilled dataset that can be effectively used to facilitate self-supervised pre-training. To this end, we propose a novel problem of distilling an unlabeled dataset into a set of small synthetic samples for efficient self-supervised learning (SSL). We first prove that a gradient of synthetic samples with respect to a SSL objective in naive bilevel optimization is \textit{biased} due to the randomness originating from data augmentations or masking for inner optimization. To address this issue, we propose to minimize the mean squared error (MSE) between a model's representations of the synthetic examples and their corresponding learnable target feature representations for the inner objective, which does not introduce any randomness. Our primary motivation is that the model obtained by the proposed inner optimization can mimic the \textit{self-supervised target model}. To achieve this, we also introduce the MSE between representations of the inner model and the self-supervised target model on the original full dataset for outer optimization. We empirically validate the effectiveness of our method on transfer learning. Our code is available at https://github.com/db-Lee/selfsup_dd

Masked Video Autoencoder (MVA) approaches have demonstrated their potential by significantly outperforming previous video representation learning methods. However, they waste an excessive amount of computations and memory in predicting uninformative tokens/frames due to random masking strategies. (e.g., over 16 nodes with 128 NVIDIA A100 GPUs). To resolve this issue, we exploit the unequal information density among the patches in videos and propose EVEREST, a surprisingly efficient MVA approach for video representation learning that finds tokens containing rich motion features and discards uninformative ones during both pre-training and fine-tuning. We further present an information-intensive frame selection strategy that allows the model to focus on informative and causal frames with minimal redundancy. Our method significantly reduces the computation and memory requirements of MVA, enabling the pre-training and fine-tuning on a single machine with 8 GPUs while achieving comparable performance to computation- and memory-heavy baselines on multiple benchmarks and the uncurated Ego4D dataset. We hope that our work contributes to reducing the barrier to further research on video understanding.

Learning the distribution of data on Riemannian manifolds is crucial for modeling data from non-Euclidean space, which is required by many applications in diverse scientific fields. Yet, existing generative models on manifolds suffer from expensive divergence computation or rely on approximations of heat kernel. These limitations restrict their applicability to simple geometries and hinder scalability to high dimensions. In this work, we introduce the Riemannian Diffusion Mixture, a principled framework for building a generative diffusion process on manifolds. Instead of following the denoising approach of previous diffusion models, we construct a diffusion process using a mixture of bridge processes derived on general manifolds without requiring heat kernel estimations. We develop a geometric understanding of the mixture process, deriving the drift as a weighted mean of tangent directions to the data points that guides the process toward the data distribution. We further propose a scalable training objective for learning the mixture process that readily applies to general manifolds. Our method achieves superior performance on diverse manifolds with dramatically reduced number of in-training simulation steps for general manifolds.

Generation of graphs is a major challenge for real-world tasks that require understanding the complex nature of their non-Euclidean structures. Although diffusion models have achieved notable success in graph generation recently, they are ill-suited for modeling the topological properties of graphs since learning to denoise the noisy samples does not explicitly learn the graph structures to be generated. To tackle this limitation, we propose a generative framework that models the topology of graphs by explicitly learning the final graph structures of the diffusion process. Specifically, we design the generative process as a mixture of endpoint-conditioned diffusion processes which is driven toward the predicted graph that results in rapid convergence. We further introduce a simple parameterization of the mixture process and develop an objective for learning the final graph structure, which enables maximum likelihood training. Through extensive experimental validation on general graph and 2D/3D molecule generation tasks, we show that our method outperforms previous generative models, generating graphs with correct topology with both continuous (e.g. 3D coordinates) and discrete (e.g. atom types) features. Our code is available at https://github.com/harryjo97/GruM.

Fragment-based drug discovery is an effective strategy for discovering drug candidates in the vast chemical space, and has been widely employed in molecular generative models. However, many existing fragment extraction methods in such models do not take the target chemical properties into account or rely on heuristic rules. Additionally, the existing fragment-based generative models cannot update the fragment vocabulary with goal-aware fragments newly discovered during the generation. To this end, we propose a molecular generative framework for drug discovery, named *Goal-aware fragment Extraction, Assembly, and Modification* (GEAM). GEAM consists of three modules, each responsible for goal-aware fragment extraction, fragment assembly, and fragment modification. The fragment extraction module identifies important fragments contributing to the desired target properties with the information bottleneck principle, thereby constructing an effective goal-aware fragment vocabulary. Moreover, GEAM can explore beyond the initial vocabulary with the fragment modification module, and the exploration is further enhanced through the dynamic goal-aware vocabulary update. We experimentally demonstrate that GEAM effectively discovers drug candidates through the generative cycle of the three modules in various drug discovery tasks. Our code is available at https://github.com/SeulLee05/GEAM.

Continual Test-Time Adaptation (CTTA) is designed to optimize the model during deployment under changing conditions. CTTA is an important problem as it enables models to remain effective and reliable in dynamic and evolving environments. However, tackling the CTTA problem is nontrivial. The model needs to be computationally and memory-efficient to rapidly update its parameters for ever-changing environments in real-time. Also, the model should generalize well to new unseen domains while maintaining its capability on previously encountered ones, as old domains can be revisited in future adaptation phases. To tackle these challenges, this paper proposes BECoTTA, a parameter/memory-efficient yet powerful framework for CTTA. We introduce Mixture-of-Domain Low-rank Experts (MoDE) that contains two core components: ?i) Domain-Adaptive Routing, which can aid in selectively capturing the domain-adaptive knowledge, and ii) Domain-Expert Synergy Loss to maximize the dependency between each domain and expert. We validate our proposed method over multiple CTTA benchmarks, getting 5.81% performance gain, while only requiring 0.001x trainable parameters. We also provide analyses of our BECoTTA, including expert assignment and target domain relation.

Continuously learning a variety of audio-video semantics over time is crucial for audio-related reasoning tasks in our ever-evolving world. However, this is a nontrivial problem and poses two critical challenges: sparse spatio-temporal correlation between audio-video pairs and multimodal correlation overwriting that forgets audio-video relations. To tackle this problem, we propose a new continual audio-video pre-training method with two novel ideas: (1) Localized Patch Importance Scoring: we introduce a multimodal encoder to determine the importance score for each patch, emphasizing semantically intertwined audio-video patches. (2) Replay-guided Correlation Assessment: to reduce the corruption of previously learned audiovisual knowledge due to drift, we propose to assess the correlation of the current patches on the past steps to identify the patches exhibiting high correlations with the past steps. Based on the results from the two ideas, we perform probabilistic patch selection for effective continual audio-video pre-training. Experimental validation on multiple benchmarks shows that our method achieves a $3.69\%$p of relative performance gain in zero-shot retrieval tasks compared to strong continual learning baselines, while reducing memory consumption by $\sim 45 \%$.

Large Language Models (LLMs) exhibit strong generalization capabilities to novel tasks when prompted with language instructions and in-context demos. Since this ability sensitively depends on the quality of prompts, various methods have been explored to automate the instruction design. While these methods demonstrated promising results, they also restricted the searched prompt to one instruction. Such simplification significantly limits their capacity, as a single demo-free instruction might not be able to cover the entire complex problem space of the targeted task. To alleviate this issue, we adopt the Mixture-of-Expert paradigm and divide the problem space into a set of sub-regions; Each sub-region is governed by a specialized expert, equipped with both an instruction and a set of demos. A two-phase process is developed to construct the specialized expert for each region: (1) demo assignment: Inspired by the theoretical connection between in-context learning and kernel regression, we group demos into experts based on their semantic similarity; (2) instruction assignment: A region-based joint search of an instruction per expert complements the demos assigned to it, yielding a synergistic effect. The resulting method, codenamed Mixture-of-Prompts (MoP), achieves an average win rate of 81% against prior arts across several major benchmarks.

Soyeong Jeong, Jinheon Baek, Sukmin Cho, Sung Ju Hwang, Jong Park. Proceedings of the 2024 Conference of the North American Chapter of the Association for Computational Linguistics: Human Language Technologies (Volume 1: Long Papers). 2024.

Yujin Kim, Jaehong Yoon, Seonghyeon Ye, Sangmin Bae, Namgyu Ho, Sung Ju Hwang, Se-Young Yun. Proceedings of the 2024 Conference of the North American Chapter of the Association for Computational Linguistics: Human Language Technologies (Volume 1: Long Papers). 2024.

We propose a neural network weight encoding method for network property prediction that utilizes set-to-set and set-to-vector functions to efficiently encode neural network parameters. Our approach is capable of encoding neural networks in a model zoo of mixed architecture and different parameter sizes as opposed to previous approaches that require custom encoding models for different architectures. Furthermore, our \textbf{S}et-based \textbf{N}eural network \textbf{E}ncoder (SNE) takes into consideration the hierarchical computational structure of neural networks. To respect symmetries inherent in network weight space, we utilize Logit Invariance to learn the required minimal invariance properties. Additionally, we introduce a \textit{pad-chunk-encode} pipeline to efficiently encode neural network layers that is adjustable to computational and memory constraints. We also introduce two new tasks for neural network property prediction: cross-dataset and cross-architecture. In cross-dataset property prediction, we evaluate how well property predictors generalize across model zoos trained on different datasets but of the same architecture. In cross-architecture property prediction, we evaluate how well property predictors transfer to model zoos of different architecture not seen during training. We show that SNE outperforms the relevant baselines on standard benchmarks.

Text-to-image diffusion models have shown remarkable success in generating personalized subjects based on a few reference images. However, current methods often fail when generating multiple subjects simultaneously, resulting in mixed identities with combined attributes from different subjects. In this work, we present MuDI, a novel framework that enables multi-subject personalization by effectively decoupling identities from multiple subjects. Our main idea is to utilize segmented subjects generated by a foundation model for segmentation (Segment Anything) for both training and inference, as a form of data augmentation for training and initialization for the generation process. Moreover, we further introduce a new metric to better evaluate the performance of our method on multi-subject personalization. Experimental results show that our MuDI can produce high-quality personalized images without identity mixing, even for highly similar subjects as shown in Figure 1. Specifically, in human evaluation, MuDI obtains twice the success rate for personalizing multiple subjects without identity mixing over existing baselines and is preferred over 70% against the strongest baseline.

As Large Language Models (LLMs) are increasingly deployed in specialized domains with continuously evolving knowledge, the need for timely and precise knowledge injection has become essential. Fine-tuning with paraphrased data is a common approach to enhance knowledge injection, yet it faces two significant challenges: high computational costs due to repetitive external model usage and limited sample diversity. To this end, we introduce LaPael, a latent-level paraphrasing method that applies input-dependent noise to early LLM layers. This approach enables diverse and semantically consistent augmentations directly within the model. Furthermore, it eliminates the recurring costs of paraphrase generation for each knowledge update. Our extensive experiments on question-answering benchmarks demonstrate that LaPael improves knowledge injection over standard fine-tuning and existing noise-based approaches. Additionally, combining LaPael with data-level paraphrasing further enhances performance.

As text-to-image (T2I) synthesis models increase in size, they demand higher inference costs due to the need for more expensive GPUs with larger memory, which makes it challenging to reproduce these models in addition to the restricted access to training datasets. Our study aims to reduce these inference costs and explores how far the generative capabilities of T2I models can be extended using only publicly available datasets and open-source models. To this end, by using the de facto standard text-to-image model, Stable Diffusion XL (SDXL), we present three key practices in building an efficient T2I model: (1) Knowledge distillation: we explore how to effectively distill the generation capability of SDXL into an efficient U-Net and find that self-attention is the most crucial part. (2) Data: despite fewer samples, high-resolution images with rich captions are more crucial than a larger number of low-resolution images with short captions. (3) Teacher: Step-distilled Teacher allows T2I models to reduce the noising steps. Based on these findings, we build two types of efficient text-to-image models, called KOALA-Turbo & -Lightning, with two compact U-Nets (1B & 700M), reducing the model size up to 54% and 69% of the SDXL U-Net. In particular, the KOALA-Lightning-700M is 4 times faster than SDXL while still maintaining satisfactory generation quality. Moreover, unlike SDXL, our KOALA models can generate 1024px high-resolution images on consumer-grade GPUs with 8GB of VRAMs (3060Ti). We believe that our KOALA models will have a significant practical impact, serving as cost-effective alternatives to SDXL for academic researchers and general users in resource-constrained environments.

There has been a surge of interest in utilizing Knowledge Graphs (KGs) for various natural language processing/understanding tasks.The conventional mechanism to retrieve facts in KGs usually involves three steps: entity span detection, entity disambiguation, and relation classification.However, this approach requires additional labels for training each of the three subcomponents in addition to pairs of input texts and facts, and also may accumulate errors propagated from failures in previous steps.To tackle these limitations, we propose a simple knowledge retrieval framework, which directly retrieves facts from the KGs given the input text based on their representational similarities, which we refer to as Direct Fact Retrieval (Di-FaR).Specifically, we first embed all facts in KGs onto a dense embedding space by using a language model trained by only pairs of input texts and facts, and then provide the nearest facts in response to the input text.Since the fact, consisting of only two entities and one relation, has little context to encode, we propose to further refine ranks of top-k retrieved facts with a reranker that contextualizes the input text and the fact jointly.We validate our Di-FaR framework on multiple fact retrieval tasks, showing that it significantly outperforms relevant baselines that use the three-step approach.

Transformer-based Language Models (LMs) have achieved impressive results on natural language understanding tasks, but they can also generate toxic text such as insults, threats, and profanity, limiting their real-world applications.To overcome this issue, a few text generation approaches aim to detoxify toxic texts using additional LMs or perturbations.However, previous methods require excessive memory, computations, and time which are serious bottlenecks in their real-world application.To address such limitations, we propose an effective yet efficient method for language detoxification using an attribute-discriminative latent space.Specifically, we project the latent space of an original Transformer LM onto a discriminative latent space that well-separates texts by their attributes using a projection block and an attribute discriminator.This allows the LM to control the text generation to be nontoxic with minimal memory and computation overhead.We validate our model, Attribute-Discriminative Language Model (ADLM) on detoxified language and dialogue generation tasks, on which our method significantly outperforms baselines both in performance and efficiency.

In this paper, we introduce a novel learning scheme named weakly semi-supervised instance segmentation (WS-SIS) with point labels for budget-efficient and high-performance instance segmentation. Namely, we consider a dataset setting consisting of a few fully-labeled images and a lot of point-labeled images. Motivated by the main challenge of semi-supervised approaches mainly derives from the trade-off between false-negative and false-positive instance proposals, we propose a method for WSSIS that can effectively leverage the budget-friendly point labels as a powerful weak supervision source to resolve the challenge. Furthermore, to deal with the hard case where the amount of fully-labeled data is extremely limited, we propose a MaskRefineNet that refines noise in rough masks. We conduct extensive experiments on COCO and BDD 100K datasets, and the proposed method achieves promising results comparable to those of the fully-supervised model, even with 50% of the fully labeled COCO data (38.8% vs. 39.7%). Moreover, when using as little as 5% of fully labeled COCO data, our method shows significantly superior performance over the state-of-the-art semi-supervised learning method (33.7% vs. 24.9%). The code is available at https://github.com/clovaai/PointWSSIS.

Conversational Question Answering (ConvQA) models aim at answering a question with its relevant paragraph and previous question-answer pairs that occurred during conversation multiple times.To apply such models to a real-world scenario, some existing work uses predicted answers, instead of unavailable ground-truth answers, as the conversation history for inference.However, since these models usually predict wrong answers, using all the predictions without filtering significantly hampers the model performance.To address this problem, we propose to filter out inaccurate answers in the conversation history based on their estimated confidences and uncertainties from the Con-vQA model, without making any architectural changes.Moreover, to make the confidence and uncertainty values more reliable, we propose to further calibrate them, thereby smoothing the model predictions.We validate our models, Answer Selection-based realistic Conversation Question Answering, on two standard ConvQA datasets, and the results show that our models significantly outperform relevant baselines.

Recent Language Models (LMs) have shown impressive capabilities in generating texts with the knowledge internalized in parameters.Yet, LMs often generate the factually incorrect responses to the given queries, since their knowledge may be inaccurate, incomplete, and outdated.To address this problem, previous works propose to augment LMs with the knowledge retrieved from an external knowledge source.However, such approaches often show suboptimal text generation performance due to two reasons: 1) the model may fail to retrieve the knowledge relevant to the given query, or 2) the model may not faithfully reflect the retrieved knowledge in the generated text.To overcome these, we propose to verify the output and the knowledge of the knowledge-augmented LMs with a separate verifier, which is a small LM that is trained to detect those two types of errors through instruction-finetuning.Then, when the verifier recognizes an error, we can rectify it by either retrieving new knowledge or generating new text.Further, we use an ensemble of the outputs from different instructions with a single verifier to enhance the reliability of the verification processes.We validate the effectiveness of the proposed verification steps on multiple question answering benchmarks, whose results show that the proposed verifier effectively identifies retrieval and generation errors, allowing LMs to provide more factually correct outputs.Our code is available at https://github.com/JinheonBaek/KALMV.

There has been a significant progress in Text-To-Speech (TTS) synthesis technology in recent years, thanks to the advancement in neural generative modeling. However, existing methods on any-speaker adaptive TTS have achieved unsatisfactory performance, due to their suboptimal accuracy in mimicking the target speakers’ styles. In this work, we present Grad-StyleSpeech, which is an any-speaker adaptive TTS framework that is based on a diffusion model that can generate highly natural speech with extremely high similarity to target speakers’ voice, given a few seconds of reference speech. Grad-StyleSpeech significantly outperforms recent speaker-adaptive TTS baselines on English benchmarks. Audio samples are available at https://nardien.github.io/grad-stylespeech-demo.

Token-based masked generative models are gaining popularity for their fast inference time with parallel decoding. While recent token-based approaches achieve competitive performance to diffusion-based models, their generation performance is still suboptimal as they sample multiple tokens simultaneously without considering the dependence among them. We empirically investigate this problem and propose a learnable sampling model, Text-Conditioned Token Selection (TCTS), to select optimal tokens via localized supervision with text information. TCTS improves not only the image quality but also the semantic alignment of the generated images with the given texts. To further improve the image quality, we introduce a cohesive sampling strategy, Frequency Adaptive Sampling (FAS), to each group of tokens divided according to the self-attention maps. We validate the efficacy of TCTS combined with FAS with various generative tasks, demonstrating that it significantly outperforms the baselines in image-text alignment and image quality. Our text-conditioned sampling framework further reduces the original inference time by more than 50 % without modifying the original generative model.

Subgraphs of a larger global graph may be distributed across multiple devices, and only locally accessible due to privacy restrictions, although there may be links between subgraphs. Recently proposed subgraph Federated Learning (FL) methods deal with those missing links across local subgraphs while distributively training Graph Neural Networks (GNNs) on them. However, they have overlooked the inevitable heterogeneity between subgraphs comprising different communities of a global graph, consequently collapsing the incompatible knowledge from local GNN models. To this end, we introduce a new subgraph FL problem, personalized subgraph FL, which focuses on the joint improvement of the interrelated local GNNs rather than learning a single global model, and propose a novel framework, FEDerated Personalized sUBgraph learning (FED-PUB), to tackle it. Since the server cannot access the subgraph in each client, FED-PUB utilizes functional embeddings of the local GNNs using random graphs as inputs to compute similarities between them, and use the similarities to perform weighted averaging for server-side aggregation. Further, it learns a personalized sparse mask at each client to select and update only the subgraph-relevant subset of the aggregated parameters. We validate our FED-PUB for its subgraph FL performance on six datasets, considering both non-overlapping and overlapping subgraphs, on which it significantly outperforms relevant baselines. Our code is available at https://github.com/JinheonBaek/FED-PUB.

As Machine Learning as a Service (MLaaS) platforms become prevalent, deep neural network (DNN) watermarking techniques are gaining increasing attention, which enables one to verify the ownership of a target DNN model in a black-box scenario. Unfortunately, previous watermarking methods are vulnerable to functionality stealing attacks, thus allowing an adversary to falsely claim the ownership of a DNN model stolen from its original owner. In this work, we propose a novel margin-based DNN watermarking approach that is robust to the functionality stealing attacks based on model extraction and distillation. Specifically, during training, our method maximizes the margins of watermarked samples by using projected gradient ascent on them so that their predicted labels cannot change without compromising the accuracy of the model that the attacker tries to steal. We validate our method on multiple benchmarks and show that our watermarking method successfully defends against model extraction attacks, outperforming recent baselines.

A well-known limitation of existing molecular generative models is that the generated molecules highly resemble those in the training set. To generate truly novel molecules that may have even better properties for de novo drug discovery, more powerful exploration in the chemical space is necessary. To this end, we propose Molecular Out-Of-distribution Diffusion(MOOD), a score-based diffusion scheme that incorporates out-of-distribution (OOD) control in the generative stochastic differential equation (SDE) with simple control of a hyperparameter, thus requires no additional costs. Since some novel molecules may not meet the basic requirements of real-world drugs, MOOD performs conditional generation by utilizing the gradients from a property predictor that guides the reverse-time diffusion process to high-scoring regions according to target properties such as protein-ligand interactions, drug-likeness, and synthesizability. This allows MOOD to search for novel and meaningful molecules rather than generating unseen yet trivial ones. We experimentally validate that MOOD is able to explore the chemical space beyond the training distribution, generating molecules that outscore ones found with existing methods, and even the top 0.01% of the original training pool. Our code is available at https://github.com/SeulLee05/MOOD.

Recent work on mini-batch consistency (MBC) for set functions has brought attention to the need for sequentially processing and aggregating chunks of a partitioned set while guaranteeing the same output for all partitions. However, existing constraints on MBC architectures lead to models with limited expressive power. Additionally, prior work has not addressed how to deal with large sets during training when the full set gradient is required. To address these issues, we propose a Universally MBC (UMBC) class of set functions which can be used in conjunction with arbitrary non-MBC components while still satisfying MBC, enabling a wider range of function classes to be used in MBC settings. Furthermore, we propose an efficient MBC training algorithm which gives an unbiased approximation of the full set gradient and has a constant memory overhead for any set size for both train- and test-time. We conduct extensive experiments including image completion, text classification, unsupervised clustering, and cancer detection on high-resolution images to verify the efficiency and efficacy of our scalable set encoding framework. Our code is available at github.com/jeffwillette/umbc

Motivated by the efficiency and rapid convergence of pre-trained models for solving downstream tasks, this paper extensively studies the impact of Continual Learning (CL) models as pre-trainers. We find that, in both supervised and unsupervised CL, the transfer quality of representations does not show a noticeable degradation of fine-tuning performance but rather increases gradually. This is because CL models can learn improved task-general features when easily forgetting task-specific knowledge. Based on this observation, we suggest a new unsupervised CL framework with masked modeling, which aims to capture fluent task-generic representation during training. Furthermore, we propose a new fine-tuning scheme, GLobal Attention Discretization (GLAD), that preserves rich task-generic representation during solving downstream tasks. The model fine-tuned with GLAD achieves competitive performance and can also be used as a good pre-trained model itself. We believe this paper breaks the barriers between pre-training and fine-tuning steps and leads to a sustainable learning framework in which the continual learner incrementally improves model generalization, yielding better transfer to unseen tasks.

Recent neural architecture search (NAS) frameworks have been successful in finding optimal architectures for given conditions (e.g., performance or latency). However, they search for optimal architectures in terms of their performance on clean images only, while robustness against various types of perturbations or corruptions is crucial in practice. Although there exist several robust NAS frameworks that tackle this issue by integrating adversarial training into one-shot NAS, however, they are limited in that they only consider robustness against adversarial attacks and require significant computational resources to discover optimal architectures for a single task, which makes them impractical in real-world scenarios. To address these challenges, we propose a novel lightweight robust zero-cost proxy that considers the consistency across features, parameters, and gradients of both clean and perturbed images at the initialization state. Our approach facilitates an efficient and rapid search for neural architectures capable of learning generalizable features that exhibit robustness across diverse perturbations. The experimental results demonstrate that our proxy can rapidly and efficiently search for neural architectures that are consistently robust against various perturbations on multiple benchmark datasets and diverse search spaces, largely outperforming existing clean zero-shot NAS and robust NAS with reduced search cost.

3D object detection (3DOD) from multi-view images is an economically appealing alternative to expensive LiDAR-based detectors, but also an extremely challenging task due to the absence of precise spatial cues. Recent studies have leveraged the teacher-student paradigm for cross-modal distillation, where a strong LiDAR-modality teacher transfers useful knowledge to a multi-view-based image-modality student. However, prior approaches have only focused on minimizing global distances between cross-modal features, which may lead to suboptimal knowledge distillation results. Based on these insights, we propose a novel structural and temporal cross-modal knowledge distillation (STXD) framework for multi-view 3DOD. First, STXD reduces redundancy of the feature components of the student by regularizing the cross-correlation of cross-modal features, while maximizing their similarities. Second, to effectively transfer temporal knowledge, STXD encodes temporal relations of features across a sequence of frames via similarity maps. Lastly, STXD also adopts a response distillation method to further enhance the quality of knowledge distillation at the output-level. Our extensive experiments demonstrate that STXD significantly improves the NDS and mAP of the based student detectors by 2.8%~4.5% on the nuScenes testing dataset.

Large Language Models (LLMs) have shown promising performance in knowledge-intensive reasoning tasks that require a compound understanding of knowledge. However, deployment of the LLMs in real-world applications can be challenging due to their high computational requirements and concerns on data privacy. Previous studies have focused on building task-specific small Language Models (LMs) by fine-tuning them with labeled data or distilling LLMs. However, these approaches are ill-suited for knowledge-intensive reasoning tasks due to the limited capacity of small LMs in memorizing the knowledge required. Motivated by our theoretical analysis on memorization, we propose Knowledge-Augmented Reasoning Distillation (KARD), a novel method that fine-tunes small LMs to generate rationales obtained from LLMs with augmented knowledge retrieved from an external knowledge base. Moreover, we further propose a neural reranker to obtain documents relevant to rationale generation. We empirically show that KARD significantly improves the performance of small T5 and GPT models on the challenging knowledge-intensive reasoning datasets, namely MedQA-USMLE, StrategyQA, and OpenbookQA. Notably, our method makes the 250M T5 models achieve superior performance against the fine-tuned 3B models, having 12 times larger parameters, on both MedQA-USMLE and StrategyQA benchmarks.

Recently, unsupervised adversarial training (AT) has been highlighted as a means of achieving robustness in models without any label information. Previous studies in unsupervised AT have mostly focused on implementing self-supervised learning (SSL) frameworks, which maximize the instance-wise classification loss to generate adversarial examples. However, we observe that simply maximizing the self-supervised training loss with an untargeted adversarial attack often results in generating ineffective adversaries that may not help improve the robustness of the trained model, especially for non-contrastive SSL frameworks without negative examples. To tackle this problem, we propose a novel positive mining for targeted adversarial attack to generate effective adversaries for adversarial SSL frameworks. Specifically, we introduce an algorithm that selects the most confusing yet similar target example for a given instance based on entropy and similarity, and subsequently perturbs the given instance towards the selected target. Our method demonstrates significant enhancements in robustness when applied to non-contrastive SSL frameworks, and less but consistent robustness improvements with contrastive SSL frameworks, on the benchmark datasets.

The Mixup scheme suggests mixing a pair of samples to create an augmented training sample and has gained considerable attention recently for improving the generalizability of neural networks. A straightforward and widely used extension of Mixup is to combine with regional dropout-like methods: removing random patches from a sample and replacing it with the features from another sample. Albeit their simplicity and effectiveness, these methods are prone to create harmful samples due to their randomness. To address this issue, 'maximum saliency' strategies were recently proposed: they select only the most informative features to prevent such a phenomenon. However, they now suffer from lack of sample diversification as they always deterministically select regions with maximum saliency, injecting bias into the augmented data. In this paper, we present, a novel, yet simple Mixup-variant that captures the best of both worlds. Our idea is two-fold. By stochastically sampling the features and ‘grafting’ them onto another sample, our method effectively generates diverse yet meaningful samples. Its second ingredient is to produce the label of the grafted sample by mixing the labels in a saliency-calibrated fashion, which rectifies supervision misguidance introduced by the random sampling procedure. Our experiments under CIFAR, Tiny-ImageNet, and ImageNet datasets show that our scheme outperforms the current state-of-the-art augmentation strategies not only in terms of classification accuracy, but is also superior in coping under stress conditions such as data corruption and object occlusion.

Adversarial training (AT) is currently one of the most successful methods to obtain the adversarial robustness of deep neural networks. However, the phenomenon of robust overfitting, i.e., the robustness starts to decrease significantly during AT, has been problematic, not only making practitioners consider a bag of tricks for a successful training, e.g., early stopping, but also incurring a significant generalization gap in the robustness. In this paper, we propose an effective regularization technique that prevents robust overfitting by optimizing an auxiliary `consistency' regularization loss during AT. Specifically, we discover that data augmentation is a quite effective tool to mitigate the overfitting in AT, and develop a regularization that forces the predictive distributions after attacking from two different augmentations of the same instance to be similar with each other. Our experimental results demonstrate that such a simple regularization technique brings significant improvements in the test robust accuracy of a wide range of AT methods. More remarkably, we also show that our method could significantly help the model to generalize its robustness against unseen adversaries, e.g., other types or larger perturbations compared to those used during training. Code is available at https://github.com/alinlab/consistency-adversarial.

Dense computer vision tasks such as object detection and segmentation require effective multi-scale feature representation for detecting or classifying objects or regions with varying sizes. While Convolutional Neural Networks (CNNs) have been the dominant architectures for such tasks, recently introduced Vision Transformers (ViTs) aim to replace them as a backbone. Similar to CNNs, ViTs build a simple multi-stage structure (i.e., fine-to-coarse) for multi-scale representation with single-scale patches. In this work, with a different perspective from existing Transformers, we explore multi-scale patch embedding and multi-path structure, constructing the Multi-Path Vision Transformer (MPViT). MPViT embeds features of the same size (i.e., sequence length) with patches of different scales simultaneously by using overlapping convolutional patch embedding. Tokens of different scales are then independently fed into the Transformer encoders via multiple paths and the resulting features are aggregated, enabling both fine and coarse feature representations at the same feature level. Thanks to the diverse, multi-scale feature representations, our MPViTs scaling from tiny (5M) to base (73M) consistently achieve superior performance over state-of-the-art Vision Transformers on ImageNet classification, object detection, instance segmentation, and semantic segmentation.

Deep models are designed to operate on huge volumes of high dimensional data such as images. In order to reduce the volume of data these models must process, we propose a set-based two-stage end-to-end neural subsampling model that is jointly optimized with an arbitrary downstream task network (e.g. classifier). In the first stage, we efficiently subsample candidate elements using conditionally independent Bernoulli random variables by capturing coarse grained global information using set encoding functions, followed by conditionally dependent autoregressive subsampling of the candidate elements using Categorical random variables by modeling pair-wise interactions using set attention networks in the second stage. We apply our method to feature and instance selection and show that it outperforms the relevant baselines under low subsampling rates on a variety of tasks including image classification, image reconstruction, function reconstruction and few-shot classification. Additionally, for nonparametric models such as Neural Processes that require to leverage the whole training data at inference time, we show that our method enhances the scalability of these models.

Generating graph-structured data requires learning the underlying distribution of graphs. Yet, this is a challenging problem, and the previous graph generative methods either fail to capture the permutation-invariance property of graphs or cannot sufficiently model the complex dependency between nodes and edges, which is crucial for generating real-world graphs such as molecules. To overcome such limitations, we propose a novel score-based generative model for graphs with a continuous-time framework. Specifically, we propose a new graph diffusion process that models the joint distribution of the nodes and edges through a system of stochastic differential equations (SDEs). Then, we derive novel score matching objectives tailored for the proposed diffusion process to estimate the gradient of the joint log-density with respect to each component, and introduce a new solver for the system of SDEs to efficiently sample from the reverse diffusion process. We validate our graph generation method on diverse datasets, on which it either achieves significantly superior or competitive performance to the baselines. Further analysis shows that our method is able to generate molecules that lie close to the training distribution yet do not violate the chemical valency rule, demonstrating the effectiveness of the system of SDEs in modeling the node-edge relationships.

Inspired by Lottery Ticket Hypothesis that competitive subnetworks exist within a dense network, we propose a continual learning method referred to as Winning SubNetworks (WSN), which sequentially learns and selects an optimal subnetwork for each task. Specifically, WSN jointly learns the model weights and task-adaptive binary masks pertaining to subnetworks associated with each task whilst attempting to select a small set of weights to be activated (winning ticket) by reusing weights of the prior subnetworks. The proposed method is inherently immune to catastrophic forgetting as each selected subnetwork model does not infringe upon other subnetworks. Binary masks spawned per winning ticket are encoded into one N-bit binary digit mask, then compressed using Huffman coding for a sub-linear increase in network capacity with respect to the number of tasks.

In practical federated learning scenarios, the participating devices may have different bitwidths for computation and memory storage by design. However, despite the progress made in device-heterogeneous federated learning scenarios, the heterogeneity in the bitwidth specifications in the hardware has been mostly overlooked. We introduce a pragmatic FL scenario with bitwidth heterogeneity across the participating devices, dubbed as Bitwidth Heterogeneous Federated Learning (BHFL). BHFL brings in a new challenge, that the aggregation of model parameters with different bitwidths could result in severe performance degeneration, especially for high-bitwidth models. To tackle this problem, we propose ProWD framework, which has a trainable weight dequantizer at the central server that progressively reconstructs the low-bitwidth weights into higher bitwidth weights, and finally into full-precision weights. ProWD further selectively aggregates the model parameters to maximize the compatibility across bit-heterogeneous weights. We validate ProWD against relevant FL baselines on the benchmark datasets, using clients with varying bitwidths. Our ProWD largely outperforms the baseline FL algorithms as well as naive approaches (e.g. grouped averaging) under the proposed BHFL scenario.

Pre-trained language models (PLMs) have achieved remarkable success on various natural language understanding tasks.Simple fine-tuning of PLMs, on the other hand, might be suboptimal for domain-specific tasks because they cannot possibly cover knowledge from all domains.While adaptive pre-training of PLMs can help them obtain domain-specific knowledge, it requires a large training cost.Moreover, adaptive pre-training can harm the PLM's performance on the downstream task by causing catastrophic forgetting of its general knowledge.To overcome such limitations of adaptive pre-training for PLM adaption, we propose a novel domain adaption framework for PLMs coined as Knowledge-Augmented Language model Adaptation (KALA), which modulates the intermediate hidden representations of PLMs with domain knowledge, consisting of entities and their relational facts.We validate the performance of our KALA on question answering and named entity recognition tasks on multiple datasets across various domains.The results show that, despite being computationally efficient, our KALA largely outperforms adaptive pre-training.Code is available at

In real-world federated learning scenarios, participants could have their own personalized labels incompatible with those from other clients, due to using different label permutations or tackling completely different tasks or domains. However, most existing FL approaches cannot effectively tackle such extremely heterogeneous scenarios since they often assume that (1) all participants use a synchronized set of labels, and (2) they train on the same tasks from the same domain. In this work, to tackle these challenges, we introduce Factorized-FL, which allows to effectively tackle label- and task-heterogeneous federated learning settings by factorizing the model parameters into a pair of rank-1 vectors, where one captures the common knowledge across different labels and tasks and the other captures knowledge specific to the task for each local model. Moreover, based on the distance in the client-specific vector space, Factorized-FL performs a selective aggregation scheme to utilize only the knowledge from the relevant participants for each client. We extensively validate our method on both label- and domain-heterogeneous settings, on which it outperforms the state-of-the-art personalized federated learning methods. The code is available at https://github.com/wyjeong/Factorized-FL.

The wide adoption of deep neural networks (DNNs) in mission-critical applications has spurred the need for interpretable models that provide explanations of the model's decisions. Unfortunately, previous studies have demonstrated that model explanations facilitate information leakage, rendering DNN models vulnerable to model inversion attacks. These attacks enable the adversary to reconstruct original images based on model explanations, thus leaking privacy-sensitive features. To this end, we present Generative Noise Injector for Model Explanations (GNIME), a novel defense framework that perturbs model explanations to minimize the risk of model inversion attacks while preserving the interpretabilities of the generated explanations. Specifically, we formulate the defense training as a two-player minimax game between the inversion attack network on the one hand, which aims to invert model explanations, and the noise generator network on the other, which aims to inject perturbations to tamper with model inversion attacks. We demonstrate that GNIME significantly decreases the information leakage in model explanations, decreasing transferable classification accuracy in facial recognition models by up to 84.8% while preserving the original functionality of model explanations.

Self-supervised learning of graph neural networks (GNNs) aims to learn an accurate representation of the graphs in an unsupervised manner, to obtain transferable representations of them for diverse downstream tasks. Predictive learning and contrastive learning are the two most prevalent approaches for graph self-supervised learning. However, they have their own drawbacks. While the predictive learning methods can learn the contextual relationships between neighboring nodes and edges, they cannot learn global graph-level similarities. Contrastive learning, while it can learn global graph-level similarities, its objective to maximize the similarity between two differently perturbed graphs may result in representations that cannot discriminate two similar graphs with different properties. To tackle such limitations, we propose a framework that aims to learn the exact discrepancy between the original and the perturbed graphs, coined as Discrepancy-based Self-supervised LeArning (D-SLA). Specifically, we create multiple perturbations of the given graph with varying degrees of similarity, and train the model to predict whether each graph is the original graph or the perturbed one. Moreover, we further aim to accurately capture the amount of discrepancy for each perturbed graph using the graph edit distance. We validate our D-SLA on various graph-related downstream tasks, including molecular property prediction, protein function prediction, and link prediction tasks, on which ours largely outperforms relevant baselines.

Meta-learning approaches enable machine learning systems to adapt to new tasks given few examples by leveraging knowledge from related tasks. However, a large number of meta-training tasks are still required for generalization to unseen tasks during meta-testing, which introduces a critical bottleneck for real-world problems that come with only few tasks, due to various reasons including the difficulty and cost of constructing tasks. Recently, several task augmentation methods have been proposed to tackle this issue using domain-specific knowledge to design augmentation techniques to densify the meta-training task distribution. However, such reliance on domain-specific knowledge renders these methods inapplicable to other domains. While Manifold Mixup based task augmentation methods are domain-agnostic, we empirically find them ineffective on non-image domains. To tackle these limitations, we propose a novel domain-agnostic task augmentation method, Meta-Interpolation, which utilizes expressive neural set functions to densify the meta-training task distribution using bilevel optimization. We empirically validate the efficacy of Meta-Interpolation on eight datasets spanning across various domains such as image classification, molecule property prediction, text classification and speech recognition. Experimentally, we show that Meta-Interpolation consistently outperforms all the relevant baselines. Theoretically, we prove that task interpolation with the set function regularizes the meta-learner to improve generalization. We provide our source code in the supplementary material.

Although recent multi-task learning methods have shown to be effective in improving the generalization of deep neural networks, they should be used with caution for safety-critical applications, such as clinical risk prediction. This is because even if they achieve improved task-average performance, they may still yield degraded performance on individual tasks, which may be critical (e.g., prediction of mortality risk). Existing asymmetric multi-task learning methods tackle this negative transfer problem by performing knowledge transfer from tasks with low loss to tasks with high loss. However, using loss as a measure of reliability is risky since low loss could result from overfitting. In the case of time-series prediction tasks, knowledge learned for one task (e.g., predicting the sepsis onset) at a specific timestep may be useful for learning another task (e.g., prediction of mortality) at a later timestep, but lack of loss at each timestep makes it difficult to measure the reliability at each timestep. To capture such dynamically changing asymmetric relationships between tasks in time-series data, we propose a novel temporal asymmetric multi-task learning model that performs knowledge transfer from certain tasks/timesteps to relevant uncertain tasks, based on the feature-level uncertainty. We validate our model on multiple clinical risk prediction tasks against various deep learning models for time-series prediction, which our model significantly outperforms without any sign of negative transfer. Further qualitative analysis of learned knowledge graphs by clinicians shows that they are helpful in analyzing the predictions of the model.

Retrosynthesis is the task of predicting reactant molecules from a given product molecule and is, important in organic chemistry because the identification of a synthetic path is as demanding as the discovery of new chemical compounds. Recently, the retrosynthesis task has been solved automatically without human expertise using powerful deep learning models. Recent deep models are primarily based on seq2seq or graph neural networks depending on the function of molecular representation, sequence, or graph. Current state-of-the-art models represent a molecule as a graph, but they require joint training with auxiliary prediction tasks, such as the most probable reaction template or reaction center prediction. Furthermore, they require additional labels by experienced chemists, thereby incurring additional cost. Herein, we propose a novel template-free model, i.e., Graph Truncated Attention (GTA), which leverages both sequence and graph representations by inserting graphical information into a seq2seq model. The proposed GTA model masks the self-attention layer using the adjacency matrix of product molecule in the encoder and applies a new loss using atom mapping acquired from an automated algorithm to the cross-attention layer in the decoder. Our model achieves new state-of-the-art records, i.e., exact match top-1 and top-10 accuracies of 51.1% and 81.6% on the USPTO-50k benchmark dataset, respectively, and 46.0% and 70.0% on the USPTO-full dataset, respectively, both without any reaction class information. The GTA model surpasses prior graph-based template-free models by 2% and 7% in terms of the top-1 and top-10 accuracies on the USPTO-50k dataset, respectively, and by over 6% for both the top-1 and top-10 accuracies on the USPTO-full dataset.

Seanie Lee, Minki Kang, Juho Lee, Sung Ju Hwang. Proceedings of the 59th Annual Meeting of the Association for Computational Linguistics and the 11th International Joint Conference on Natural Language Processing (Volume 1: Long Papers). 2021.

Network quantization, which aims to reduce the bitlengths of the network weights and activations, has emerged for their deployments to resource-limited devices. Although recent studies have successfully discretized a full-precision network, they still incur large quantization errors after training, thus giving rise to a significant performance gap between a full-precision network and its quantized counterpart. In this work, we propose a novel quantization method for neural networks, Cluster-Promoting Quantization (CPQ) that finds the optimal quantization grids while naturally encouraging the underlying full-precision weights to gather around those quantization grids cohesively during training. This property of CPQ is thanks to our two main ingredients that enable differentiable quantization: i) the use of the categorical distribution designed by a specific probabilistic parametrization in the forward pass and ii) our proposed multi-class straight-through estimator (STE) in the backward pass. Since our second component, multi-class STE, is intrinsically biased, we additionally propose a new bit-drop technique, DropBits, that revises the standard dropout regularization to randomly drop bits instead of neurons. As a natural extension of DropBits, we further introduce the way of learning heterogeneous quantization levels to find proper bit-length for each layer by imposing an additional regularization on DropBits. We experimentally validate our method on various benchmark datasets and network architectures, and also support a new hypothesis for quantization: learning heterogeneous quantization levels outperforms the case using the same but fixed quantization levels from scratch.

Adversarial learning has emerged as one of the successful techniques to circumvent the susceptibility of existing methods against adversarial perturbations. However, the majority of existing defense methods are tailored to defend against a single category of adversarial perturbation (e.g. $\ell_\infty$-attack). In safety-critical applications, this makes these methods extraneous as the attacker can adopt diverse adversaries to deceive the system. Moreover, training on multiple perturbations simultaneously significantly increases the computational overhead during training. To address these challenges, we propose a novel meta-learning framework that explicitly learns to generate noise to improve the model’s robustness against multiple types of attacks. Its key component is \emph{Meta Noise Generator (MNG)} that outputs optimal noise to stochastically perturb a given sample, such that it helps lower the error on diverse adversarial perturbations. By utilizing samples generated by MNG, we train a model by enforcing the label consistency across multiple perturbations. We validate the robustness of models trained by our scheme on various datasets and against a wide variety of perturbations, demonstrating that it significantly outperforms the baselines across multiple perturbations with a marginal computational cost.

With rapid progress in neural text-to-speech (TTS) models, personalized speech generation is now in high demand for many applications. For practical applicability, a TTS model should generate high-quality speech with only a few audio samples from the given speaker, that are also short in length. However, existing methods either require to fine-tune the model or achieve low adaptation quality without fine-tuning. In this work, we propose StyleSpeech, a new TTS model which not only synthesizes high-quality speech but also effectively adapts to new speakers. Specifically, we propose Style-Adaptive Layer Normalization (SALN) which aligns gain and bias of the text input according to the style extracted from a reference speech audio. With SALN, our model effectively synthesizes speech in the style of the target speaker even from a single speech audio. Furthermore, to enhance StyleSpeech’s adaptation to speech from new speakers, we extend it to Meta-StyleSpeech by introducing two discriminators trained with style prototypes, and performing episodic training. The experimental results show that our models generate high-quality speech which accurately follows the speaker’s voice with single short-duration (1-3 sec) speech audio, significantly outperforming baselines.

Meta-learning of shared initialization parameters has shown to be highly effective in solving few-shot learning tasks. However, extending the framework to many-shot scenarios, which may further enhance its practicality, has been relatively overlooked due to the technical difficulties of meta-learning over long chains of inner-gradient steps. In this paper, we first show that allowing the meta-learners to take a larger number of inner gradient steps better captures the structure of heterogeneous and large-scale task distributions, thus results in obtaining better initialization points. Further, in order to increase the frequency of meta-updates even with the excessively long inner-optimization trajectories, we propose to estimate the required shift of the task-specific parameters with respect to the change of the initialization parameters. By doing so, we can arbitrarily increase the frequency of meta-updates and thus greatly improve the meta-level convergence as well as the quality of the learned initializations. We validate our method on a heterogeneous set of large-scale tasks, and show that the algorithm largely outperforms the previous first-order meta-learning methods in terms of both generalization performance and convergence, as well as multi-task learning and fine-tuning baselines.

While adversarial training is considered as a standard defense method against adversarial attacks for image classifiers, adversarial purification, which purifies attacked images into clean images with a standalone purification, model has shown promises as an alternative defense method. Recently, an EBM trained with MCMC has been highlighted as a purification model, where an attacked image is purified by running a long Markov-chain using the gradients of the EBM. Yet, the practicality of the adversarial purification using an EBM remains questionable because the number of MCMC steps required for such purification is too large. In this paper, we propose a novel adversarial purification method based on an EBM trained with DSM. We show that an EBM trained with DSM can quickly purify attacked images within a few steps. We further introduce a simple yet effective randomized purification scheme that injects random noises into images before purification. This process screens the adversarial perturbations imposed on images by the random noises and brings the images to the regime where the EBM can denoise well. We show that our purification method is robust against various attacks and demonstrate its state-of-the-art performances.

There has been a surge of interest in continual learning and federated learning, both of which are important in deep neural networks in real-world scenarios. Yet little research has been done regarding the scenario where each client learns on a sequence of tasks from a private local data stream. This problem of federated continual learning poses new challenges to continual learning, such as utilizing knowledge from other clients, while preventing interference from irrelevant knowledge. To resolve these issues, we propose a novel federated continual learning framework, Federated Weighted Inter-client Transfer (FedWeIT), which decomposes the network weights into global federated parameters and sparse task-specific parameters, and each client receives selective knowledge from other clients by taking a weighted combination of their task-specific parameters. FedWeIT minimizes interference between incompatible tasks, and also allows positive knowledge transfer across clients during learning. We validate our FedWeIT against existing federated learning and continual learning methods under varying degrees of task similarity across clients, and our model significantly outperforms them with a large reduction in the communication cost.

Retrosynthesis, of which the goal is to find a set of reactants for synthesizing a target product, is an emerging research area of deep learning. While the existing approaches have shown promising results, they currently lack the ability to consider availability (e.g., stability or purchasability) of the reactants or generalize to unseen reaction templates (i.e., chemical reaction rules). In this paper, we propose a new approach that mitigates the issues by reformulating retrosynthesis into a selection problem of reactants from a candidate set of commercially available molecules. To this end, we design an efficient reactant selection framework, named RetCL (retrosynthesis via contrastive learning), for enumerating all of the candidate molecules based on selection scores computed by graph neural networks. For learning the score functions, we also propose a novel contrastive training scheme with hard negative mining. Extensive experiments demonstrate the benefits of the proposed selection-based approach. For example, when all 671k reactants in the USPTO database are given as candidates, our RetCL achieves top-1 exact match accuracy of 71.3% for the USPTO-50k benchmark, while a recent transformer-based approach achieves 59.6%. We also demonstrate that RetCL generalizes well to unseen templates in various settings in contrast to template-based approaches.

Most existing set encoding algorithms operate under the implicit assumption that all the set elements are accessible, and that there are ample computational and memory resources to load the set into memory during training and inference. However, both assumptions fail when the set is excessively large such that it is impossible to load all set elements into memory, or when data arrives in a stream. To tackle such practical challenges in large-scale set encoding, the general set-function constraints of permutation invariance and equivariance are not sufficient. We introduce a new property termed Mini-Batch Consistency (MBC) that is required for large scale mini-batch set encoding. Additionally, we present a scalable and efficient attention-based set encoding mechanism that is amenable to mini-batch processing of sets, and capable of updating set representations as data arrives. The proposed method adheres to the required symmetries of invariance and equivariance as well as maintaining MBC for any partition of the input set. We perform extensive experiments and show that our method is computationally efficient and results in rich set encoding representations for set-structured data.

Most conventional Neural Architecture Search (NAS) approaches are limited in that they only generate architectures without searching for the optimal parameters. While some NAS methods handle this issue by utilizing a supernet trained on a large-scale dataset such as ImageNet, they may be suboptimal if the target tasks are highly dissimilar from the dataset the supernet is trained on. To address such limitations, we introduce a novel problem of Neural Network Search (NNS), whose goal is to search for the optimal pretrained network for a novel dataset and constraints (e.g. number of parameters), from a model zoo. Then, we propose a novel framework to tackle the problem, namely Task-Adaptive Neural Network Search (TANS). Given a model-zoo that consists of network pretrained on diverse datasets, we use a novel amortized meta-learning framework to learn a cross-modal latent space with contrastive loss, to maximize the similarity between a dataset and a high-performing network on it, and minimize the similarity between irrelevant dataset-network pairs. We validate the effectiveness and efficiency of our method on ten real-world datasets, against existing NAS/AutoML baselines. The results show that our method instantly retrieves networks that outperform models obtained with the baselines with significantly fewer training steps to reach the target performance, thus minimizing the total cost of obtaining a task-optimal network. Our code and the model-zoo are available at https://anonymous.4open.science/r/TANS-33D6

Graph neural networks have recently achieved remarkable success in representing graph-structured data, with rapid progress in both the node embedding and graph pooling methods. Yet, they mostly focus on capturing information from the nodes considering their connectivity, and not much work has been done in representing the edges, which are essential components of a graph. However, for tasks such as graph reconstruction and generation, as well as graph classification tasks for which the edges are important for discrimination, accurately representing edges of a given graph is crucial to the success of the graph representation learning. To this end, we propose a novel edge representation learning framework based on Dual Hypergraph Transformation (DHT), which transforms the edges of a graph into the nodes of a hypergraph. This dual hypergraph construction allows us to apply message-passing techniques for node representations to edges. After obtaining edge representations from the hypergraphs, we then cluster or drop edges to obtain holistic graph-level edge representations. We validate our edge representation learning method with hypergraphs on diverse graph datasets for graph representation and generation performance, on which our method largely outperforms existing graph representation learning methods. Moreover, our edge representation learning and pooling method also largely outperforms state-of-the-art graph pooling methods on graph classification, not only because of its accurate edge representation learning, but also due to its lossless compression of the nodes and removal of irrelevant edges for effective message-passing.

For deployment, neural architecture search should be hardware-aware, in order to satisfy the device-specific constraints (e.g., memory usage, latency and energy consumption) and enhance the model efficiency. Existing methods on hardware-aware NAS collect a large number of samples (e.g., accuracy and latency) from a target device, either builds a lookup table or a latency estimator. However, such approach is impractical in real-world scenarios as there exist numerous devices with different hardware specifications, and collecting samples from such a large number of devices will require prohibitive computational and monetary cost. To overcome such limitations, we propose Hardware-adaptive Efficient Latency Predictor (HELP), which formulates the device-specific latency estimation problem as a meta-learning problem, such that we can estimate the latency of a model's performance for a given task on an unseen device with a few samples. To this end, we introduce novel hardware embeddings to embed any devices considering them as black-box functions that output latencies, and meta-learn the hardware-adaptive latency predictor in a device-dependent manner, using the hardware embeddings. We validate the proposed HELP for its latency estimation performance on unseen platforms, on which it achieves high estimation performance with as few as 10 measurement samples, outperforming all relevant baselines. We also validate end-to-end NAS frameworks using HELP against ones without it, and show that it largely reduces the total time cost of the base NAS method, in latency-constrained settings.

Recently, utilizing reinforcement learning (RL) to generate molecules with desired properties has been highlighted as a promising strategy for drug design. Molecular docking program -- a physical simulation that estimates protein-small molecule binding affinity -- can be an ideal reward scoring function for RL, as it is a straightforward proxy of the therapeutic potential. Still, two imminent challenges exist for this task. First, the models often fail to generate chemically realistic and pharmacochemically acceptable molecules. Second, the docking score optimization is a difficult exploration problem that involves many local optima and less smooth surface with respect to molecular structure. To tackle these challenges, we propose a novel RL framework that generates pharmacochemically acceptable molecules with large docking scores. Our method -- Fragment-based generative RL with Explorative Experience replay for Drug design (FREED) -- constrains the generated molecules to a realistic and qualified chemical space and effectively explores the space to find drugs by coupling our fragment-based generation method and a novel error-prioritized experience replay (PER). We also show that our model performs well on both de novo and scaffold-based schemes. Our model produces molecules of higher quality compared to existing methods while achieving state-of-the-art performance on two of three targets in terms of the docking scores of the generated molecules. We further show with ablation studies that our method, predictive error-PER (FREED(PE)), significantly improves the model performance.

We present a personalized and reliable prediction model for healthcare, which can provide individually tailored medical services such as diagnosis, disease treatment, and prevention. Our proposed framework targets at making personalized and reliable predictions from time-series data, such as Electronic Health Records (EHR), by modeling two complementary components: i) a shared component that captures global trend across diverse patients and ii) a patient-specific component that models idiosyncratic variability for each patient. To this end, we propose a composite model of a deep neural network to learn complex global trends from the large number of patients, and Gaussian Processes (GP) to probabilistically model individual time-series given relatively small number of visits per patient. We evaluate our model on diverse and heterogeneous tasks from EHR datasets and show practical advantages over standard time-series deep models such as pure Recurrent Neural Network (RNN).

One of the most crucial challenges in question answering (QA) is the scarcity of labeled data, since it is costly to obtain question-answer (QA) pairs for a target text domain with human annotation.An alternative approach to tackle the problem is to use automatically generated QA pairs from either the problem context or from large amount of unstructured texts (e.g.Wikipedia).In this work, we propose a hierarchical conditional variational autoencoder (HCVAE) for generating QA pairs given unstructured texts as contexts, while maximizing the mutual information between generated QA pairs to ensure their consistency.We validate our Information Maximizing Hierarchical Conditional Variational AutoEncoder (Info-HCVAE) on several benchmark datasets by evaluating the performance of the QA model (BERT-base) using only the generated QA pairs (QA-based evaluation) or by using both the generated and human-labeled pairs (semisupervised learning) for training, against stateof-the-art baseline models.The results show that our model obtains impressive performance gains over all baselines on both tasks, using only a fraction of data for training.1

We propose a method to automatically generate a domain- and task-adaptive maskings of the given text for self-supervised pre-training, such that we can effectively adapt the language model to a particular target task (e.g. question answering). Specifically, we present a novel reinforcement learning-based framework which learns the masking policy, such that using the generated masks for further pre-training of the target language model helps improve task performance on unseen texts. We use off-policy actor-critic with entropy regularization and experience replay for reinforcement learning, and propose a Transformer-based policy network that can consider the relative importance of words in a given text. We validate our Neural Mask Generator (NMG) on several question answering and text classification datasets using BERT and DistilBERT as the language models, on which it outperforms rule-based masking strategies, by automatically learning optimal adaptive maskings.

We propose a novel interactive learning framework which we refer to as Interactive Attention Learning (IAL), in which the human supervisors interactively manipulate the allocated attentions, to correct the model’s behaviour by updating the attention-generating network. However, such a model is prone to overfitting due to scarcity of human annotations, and requires costly retraining. Moreover, it is almost infeasible for the human annotators to examine attentions on tons of instances and features. We tackle these challenges by proposing a sample-efficient attention mechanism and a cost-effective reranking algorithm for instances and features. First, we propose Neural Attention Processes (NAP), which is an attention generator that can update its behaviour by incorporating new attention-level supervisions without any retraining. Secondly, we propose an algorithm which prioritizes the instances and the features by their negative impacts, such that the model can yield large improvements with minimal human feedback. We validate IAL on various time-series datasets from multiple domains (healthcare, real-estate, and computer vision) on which it significantly outperforms baselines with conventional attention mechanisms, or without cost-effective reranking, with substantially less retraining and human-model interaction cost.

Self-supervised learning, which learns by constructing artificial labels given only the input signals, has recently gained considerable attention for learning representations with unlabeled datasets, i.e., learning without any human-annotated supervision. In this paper, we show that such a technique can be used to significantly improve the model accuracy even under fully-labeled datasets. Our scheme trains the model to learn both original and self-supervised tasks, but is different from conventional multi-task learning frameworks that optimize the summation of their corresponding losses. Our main idea is to learn a single unified task with respect to the joint distribution of the original and self-supervised labels, i.e., we augment original labels via self-supervision. This simple, yet effective approach allows to train models easier by relaxing a certain invariant constraint during learning the original and self-supervised tasks simultaneously. It also enables an aggregated inference which combines the predictions from different augmentations to improve the prediction accuracy. Furthermore, we propose a novel knowledge transfer technique, which we refer to as self-distillation, that has the effect of the aggregated inference in a single (faster) inference. We demonstrate the large accuracy improvement and wide applicability of our framework on various fully-supervised settings, e.g., the few-shot and imbalanced classification scenarios.

Despite the remarkable performance of deep neural networks on various computer vision tasks, they are known to be susceptible to adversarial perturbations, which makes it challenging to deploy them in real-world safety-critical applications. In this paper, we conjecture that the leading cause of adversarial vulnerability is the distortion in the latent feature space, and provide methods to suppress them effectively. Explicitly, we define \emph{vulnerability} for each latent feature and then propose a new loss for adversarial learning, \emph{Vulnerability Suppression (VS)} loss, that aims to minimize the feature-level vulnerability during training. We further propose a Bayesian framework to prune features with high vulnerability to reduce both vulnerability and loss on adversarial samples. We validate our \emph{Adversarial Neural Pruning with Vulnerability Suppression (ANP-VS)} method on multiple benchmark datasets, on which it not only obtains state-of-the-art adversarial robustness but also improves the performance on clean examples, using only a fraction of the parameters used by the full network. Further qualitative analysis suggests that the improvements come from the suppression of feature-level vulnerability.

Humans have the ability to robustly recognize objects with various factors of variations such as nonrigid transformations, background noises, and changes in lighting conditions. However, training deep learning models generally require huge amount of data instances under diverse variations, to ensure its robustness. To alleviate the need of collecting large amount of data and better learn to generalize with scarce data instances, we propose a novel meta-learning method which learns to transfer factors of variations from one class to another, such that it can improve the classification performance on unseen examples. Transferred variations generate virtual samples that augment the feature space of the target class during training, simulating upcoming query samples with similar variations. By sharing the factors of variations across different classes, the model becomes more robust to variations in the unseen examples and tasks using small number of examples per class. We validate our model on multiple benchmark datasets for few-shot classification and face recognition, on which our model significantly improves the performance of the base model, outperforming relevant baselines.

We propose a fast and lightweight end-to-end convolutional network architecture for real-time segmentation of high resolution videos, NfS-SegNet, that can segement 2K-videos at 36.5 FPS with 24.3 GFLOPS. This speed and computation-efficiency is due to following reasons: 1) The encoder network, NfS-Net, is optimized for speed with simple building blocks without memory-heavy operations such as depthwise convolutions, and outperforms state-of-the-art lightweight CNN architectures such as SqueezeNet [2], Mo- bileNet v1 [3] & v2 [4] and ShuffleNet v1 [5] & v2 [6] on image classification with significantly higher speed. 2) The NfS- SegNet has an asymmetric architecture with deeper encoder and shallow decoder, whose design is based on our empirical finding that the decoder is the main bottleneck in computation with relatively small contribution to the final performance. 3) Our novel uncertainty-aware knowledge distillation method guides the teacher model to focus its knowledge transfer on the most difficult image regions. We validate the performance of NfS-SegNet with the CITYSCAPE [1] benchmark, on which it achieves state-of-the-art performance among lightweight segementation models in terms of both accuracy and speed.

In practical settings, a speaker recognition system needs to identify a speaker given a short utterance, while the enrollment utterance may be relatively long.However, existing speaker recognition models perform poorly with such short utterances.To solve this problem, we introduce a meta-learning framework for imbalance length pairs.Specifically, we use a Prototypical Networks and train it with a support set of long utterances and a query set of short utterances of varying lengths.Further, since optimizing only for the classes in the given episode may be insufficient for learning discriminative embeddings for unseen classes, we additionally enforce the model to classify both the support and the query set against the entire set of classes in the training set.By combining these two learning schemes, our model outperforms existing state-of-the-art speaker verification models learned with a standard supervised learning framework on short utterance (1-2 seconds) on the VoxCeleb datasets.We also validate our proposed model for unseen speaker identification, on which it also achieves significant performance gains over the existing approaches.The codes are available at https://github.com/seongmin-kye/meta-SR.

Many practical graph problems, such as knowledge graph construction and drug-drug interaction prediction, require to handle multi-relational graphs. However, handling real-world multi-relational graphs with Graph Neural Networks (GNNs) is often challenging due to their evolving nature, as new entities (nodes) can emerge over time. Moreover, newly emerged entities often have few links, which makes the learning even more difficult. Motivated by this challenge, we introduce a realistic problem of few-shot out-of-graph link prediction, where we not only predict the links between the seen and unseen nodes as in a conventional out-of-knowledge link prediction task but also between the unseen nodes, with only few edges per node. We tackle this problem with a novel transductive meta-learning framework which we refer to as Graph Extrapolation Networks (GEN). GEN meta-learns both the node embedding network for inductive inference (seen-to-unseen) and the link prediction network for transductive inference (unseen-to-unseen). For transductive link prediction, we further propose a stochastic embedding layer to model uncertainty in the link prediction between unseen entities. We validate our model on multiple benchmark datasets for knowledge graph completion and drug-drug interaction prediction. The results show that our model significantly outperforms relevant baselines for out-of-graph link prediction tasks.

Time-reversal symmetry, which requires that the dynamics of a system should not change with the reversal of time axis, is a fundamental property that frequently holds in classical and quantum mechanics. In this paper, we propose a novel loss function that measures how well our ordinary differential equation (ODE) networks comply with this time-reversal symmetry; it is formally defined by the discrepancy in the time evolutions of ODE networks between forward and backward dynamics. Then, we design a new framework, which we name as Time-Reversal Symmetric ODE Networks (TRS-ODENs), that can learn the dynamics of physical systems more sample-efficiently by learning with the proposed loss function. We evaluate TRS-ODENs on several classical dynamics, and find they can learn the desired time evolution from observed noisy and complex trajectories. We also show that, even for systems that do not possess the full time-reversal symmetry, TRS-ODENs can achieve better predictive performances over baselines.

While semi-supervised learning (SSL) has proven to be a promising way for leveraging unlabeled data when labeled data is scarce, the existing SSL algorithms typically assume that training class distributions are balanced. However, these SSL algorithms trained under imbalanced class distributions can severely suffer when generalizing to a balanced testing criterion, since they utilize biased pseudo-labels of unlabeled data toward majority classes. To alleviate this issue, we formulate a convex optimization problem to softly refine the pseudo-labels generated from the biased model, and develop a simple algorithm, named Distribution Aligning Refinery of Pseudo-label (DARP) that solves it provably and efficiently. Under various class imbalanced semi-supervised scenarios, we demonstrate the effectiveness of DARP and its compatibility with state-of-the-art SSL schemes.

While humans can solve a visual puzzle that requires logical reasoning by observing only few samples, it would require training over a large number of samples for state-of-the-art deep reasoning models to obtain similar performance on the same task. In this work, we propose to solve such a few-shot (or low-shot) abstract visual reasoning problem by resorting to \emph{analogical reasoning}, which is a unique human ability to identify structural or relational similarity between two sets. Specifically, we construct analogical and non-analogical training pairs of two different problem instances, e.g., the latter is created by perturbing or shuffling the original (former) problem. Then, we extract the structural relations among elements in both domains in a pair by enforcing analogical ones to be as similar as possible, while minimizing similarities between non-analogical ones. This analogical contrastive learning allows to effectively learn the relational representations of given abstract reasoning tasks. We validate our method on RAVEN dataset, on which it outperforms state-of-the-art method, with larger gains when the training data is scarce. We further meta-learn our analogical contrastive learning model over the same tasks with diverse attributes, and show that it generalizes to the same visual reasoning problem with unseen attributes.

Existing adversarial learning approaches mostly use class labels to generate adversarial samples that lead to incorrect predictions, which are then used to augment the training of the model for improved robustness. While some recent works propose semi-supervised adversarial learning methods that utilize unlabeled data, they still require class labels. However, do we really need class labels at all, for adversarially robust training of deep neural networks? In this paper, we propose a novel adversarial attack for unlabeled data, which makes the model confuse the instance-level identities of the perturbed data samples. Further, we present a self-supervised contrastive learning framework to adversarially train a robust neural network without labeled data, which aims to maximize the similarity between a random augmentation of a data sample and its instance-wise adversarial perturbation. We validate our method, Robust Contrastive Learning (RoCL), on multiple benchmark datasets, on which it obtains comparable robust accuracy over state-of-the-art supervised adversarial learning methods, and significantly improved robustness against the \emph{black box} and unseen types of attacks. Moreover, with further joint fine-tuning with supervised adversarial loss, RoCL obtains even higher robust accuracy over using self-supervised learning alone. Notably, RoCL also demonstrate impressive results in robust transfer learning.

While various complexity measures for deep neural networks exist, specifying an appropriate measure capable of predicting and explaining generalization in deep networks has proven challenging. We propose Neural Complexity (NC), a meta-learning framework for predicting generalization. Our model learns a scalar complexity measure through interactions with many heterogeneous tasks in a data-driven way. The trained NC model can be added to the standard training loss to regularize any task learner in a standard supervised learning scenario. We contrast NC's approach against existing manually-designed complexity measures and other meta-learning models, and we validate NC's performance on multiple regression and classification tasks.

Unlike in the traditional statistical modeling for which a user typically hand-specify a prior, Neural Processes (NPs) implicitly define a broad class of stochastic processes with neural networks. Given a data stream, NP learns a stochastic process that best describes the data. While this ``data-driven'' way of learning stochastic processes has proven to handle various types of data, NPs still relies on an assumption that uncertainty in stochastic processes is modeled by a single latent variable, which potentially limits the flexibility. To this end, we propose the Bootstrapping Neural Process (BNP), a novel extension of the NP family using the bootstrap. The bootstrap is a classical data-driven technique for estimating uncertainty, which allows BNP to learn the stochasticity in NPs without assuming a particular form. We demonstrate the efficacy of BNP on various types of data and its robustness in the presence of model-data mismatch.

Neural networks embedded in safety-sensitive applications such as self-driving cars and wearable health monitors rely on two important techniques: input attribution for hindsight analysis and network compression to reduce its size for edge-computing. In this paper, we show that these seemingly unrelated techniques conflict with each other as network compression deforms the produced attributions, which could lead to dire consequences for mission-critical applications. This phenomenon arises due to the fact that conventional network compression methods only preserve the predictions of the network while ignoring the quality of the attributions. To combat the attribution inconsistency problem, we present a framework that can preserve the attributions while compressing a network. By employing the Weighted Collapsed Attribution Matching regularizer, we match the attribution maps of the network being compressed to its pre-compression former self. We demonstrate the effectiveness of our algorithm both quantitatively and qualitatively on diverse compression methods.

Regularization and transfer learning are two popular techniques to enhance model generalization on unseen data, which is a fundamental problem of machine learning. Regularization techniques are versatile, as they are task- and architecture-agnostic, but they do not exploit a large amount of data available. Transfer learning methods learn to transfer knowledge from one domain to another, but may not generalize across tasks and architectures, and may introduce new training cost for adapting to the target task. To bridge the gap between the two, we propose a transferable perturbation, MetaPerturb, which is meta-learned to improve generalization performance on unseen data. MetaPerturb is implemented as a set-based lightweight network that is agnostic to the size and the order of the input, which is shared across the layers. Then, we propose a meta-learning framework, to jointly train the perturbation function over heterogeneous tasks in parallel. As MetaPerturb is a set-function trained over diverse distributions across layers and tasks, it can generalize to heterogeneous tasks and architectures. We validate the efficacy and generality of MetaPerturb trained on a specific source domain and architecture, by applying it to the training of diverse neural architectures on heterogeneous target datasets against various regularizers and fine-tuning. The results show that the networks trained with MetaPerturb significantly outperform the baselines on most of the tasks and architectures, with a negligible increase in the parameter size and no hyperparameters to tune.

We consider a novel question answering (QA) task where the machine needs to read from large streaming data (long documents or videos) without knowing when the questions will be given, which is difficult to solve with existing QA methods due to their lack of scalability.To tackle this problem, we propose a novel end-to-end deep network model for reading comprehension, which we refer to as Episodic Memory Reader (EMR) that sequentially reads the input contexts into an external memory, while replacing memories that are less important for answering unseen questions.Specifically, we train an RL agent to replace a memory entry when the memory is full, in order to maximize its QA accuracy at a future timepoint, while encoding the external memory using either the GRU or the Transformer architecture to learn representations that considers relative importance between the memory entries.We validate our model on a synthetic dataset (bAbI) as well as real-world large-scale textual QA (TriviaQA) and video QA (TVQA) datasets, on which it achieves significant improvements over rulebased memory scheduling policies or an RLbased baseline that independently learns the query-specific importance of each memory.

Reducing bit-widths of activations and weights of deep networks makes it efficient to compute and store them in memory, which is crucial in their deployments to resource-limited devices, such as mobile phones. However, decreasing bit-widths with quantization generally yields drastically degraded accuracy. To tackle this problem, we propose to learn to quantize activations and weights via a trainable quantizer that transforms and discretizes them. Specifically, we parameterize the quantization intervals and obtain their optimal values by directly minimizing the task loss of the network. This quantization-interval-learning (QIL) allows the quantized networks to maintain the accuracy of the full-precision (32-bit) networks with bit-width as low as 4-bit and minimize the accuracy degeneration with further bit-width reduction (i.e., 3 and 2-bit). Moreover, our quantizer can be trained on a heterogeneous dataset, and thus can be used to quantize pretrained networks without access to their training data. We demonstrate the effectiveness of our trainable quantizer on ImageNet dataset with various network architectures such as ResNet-18, -34 and AlexNet, on which it outperforms existing methods to achieve the state-of-the-art accuracy.

As the application of deep learning has expanded to real-world problems with insufficient volume of training data, transfer learning recently has gained much attention as means of improving the performance in such small-data regime. However, when existing methods are applied between heterogeneous architectures and tasks, it becomes more important to manage their detailed configurations and often requires exhaustive tuning on them for the desired performance. To address the issue, we propose a novel transfer learning approach based on meta-learning that can automatically learn what knowledge to transfer from the source network to where in the target network. Given source and target networks, we propose an efficient training scheme to learn meta-networks that decide (a) which pairs of layers between the source and target networks should be matched for knowledge transfer and (b) which features and how much knowledge from each feature should be transferred. We validate our meta-transfer approach against recent transfer learning methods on various datasets and network architectures, on which our automated scheme significantly outperforms the prior baselines that find “what and where to transfer” in a hand-crafted manner.

We propose Deep Asymmetric Multitask Feature Learning (Deep-AMTFL) which can learn deep representations shared across multiple tasks while effectively preventing negative transfer that may happen in the feature sharing process. Specifically, we introduce an asymmetric autoencoder term that allows reliable predictors for the easy tasks to have high contribution to the feature learning while suppressing the influences of unreliable predictors for more difficult tasks. This allows the learning of less noisy representations, and enables unreliable predictors to exploit knowledge from the reliable predictors via the shared latent features. Such asymmetric knowledge transfer through shared features is also more scalable and efficient than inter-task asymmetric transfer. We validate our Deep-AMTFL model on multiple benchmark datasets for multitask learning and image classification, on which it significantly outperforms existing symmetric and asymmetric multitask learning models, by effectively preventing negative transfer in deep feature learning.

Attention mechanism is effective in both focusing the deep learning models on relevant features and interpreting them. However, attentions may be unreliable since the networks that generate them are often trained in a weakly-supervised manner. To overcome this limitation, we introduce the notion of input-dependent uncertainty to the attention mechanism, such that it generates attention for each feature with varying degrees of noise based on the given input, to learn larger variance on instances it is uncertain about. We learn this Uncertainty-aware Attention (UA) mechanism using variational inference, and validate it on various risk prediction tasks from electronic health records on which our model significantly outperforms existing attention models. The analysis of the learned attentions shows that our model generates attentions that comply with clinicians' interpretation, and provide richer interpretation via learned variance. Further evaluation of both the accuracy of the uncertainty calibration and the prediction performance with "I don't know'' decision show that UA yields networks with high reliability as well.

We propose DropMax, a stochastic version of softmax classifier which at each iteration drops non-target classes according to dropout probabilities adaptively decided for each instance. Specifically, we overlay binary masking variables over class output probabilities, which are input-adaptively learned via variational inference. This stochastic regularization has an effect of building an ensemble classifier out of exponentially many classifiers with different decision boundaries. Moreover, the learning of dropout rates for non-target classes on each instance allows the classifier to focus more on classification against the most confusing classes. We validate our model on multiple public datasets for classification, on which it obtains significantly improved accuracy over the regular softmax classifier and other baselines. Further analysis of the learned dropout probabilities shows that our model indeed selects confusing classes more often when it performs classification.

We consider the problem of active feature acquisition where the goal is to sequentially select the subset of features in order to achieve the maximum prediction performance in the most cost-effective way at test time. In this work, we formulate this active feature acquisition as a jointly learning problem of training both the classifier (environment) and the RL agent that decides either to stop and predict' orcollect a new feature' at test time, in a cost-sensitive manner. We also introduce a novel encoding scheme to represent acquired subsets of features by proposing an order-invariant set encoding at the feature level, which also significantly reduces the search space for our agent. We evaluate our model on a carefully designed synthetic dataset for the active feature acquisition as well as several medical datasets. Our framework shows meaningful feature acquisition process for diagnosis that complies with human knowledge, and outperforms all baselines in terms of prediction performance as well as feature acquisition cost.

We propose a novel deep neural network that is both lightweight and effectively structured for model parallelization. Our network, which we name as SplitNet, automatically learns to split the network weights into either a set or a hierarchy of multiple groups that use disjoint sets of features, by learning both the class-to-group and feature-to-group assignment matrices along with the network weights. This produces a tree-structured network that involves no connection between branched subtrees of semantically disparate class groups. SplitNet thus greatly reduces the number of parameters and requires significantly less computations, and is also embarrassingly model parallelizable at test time, since the network evaluation for each subnetwork is completely independent except for the shared lower layer weights that can be duplicated over multiple processors. We validate our method with two deep network models (ResNet and AlexNet) on two different datasets (CIFAR-100 and ILSVRC 2012) for image classification, on which our method obtains networks with significantly reduced number of parameters while achieving comparable or superior classification accuracies over original full deep networks, and accelerated test speed with multiple GPUs.

The number of parameters in a deep neural network is usually very large, which helps with its learning capacity but also hinders its scalability and practicality due to memory/time inefficiency and overfitting. To resolve this issue, we propose a sparsity regularization method that exploits both positive and negative correlations among the features to enforce the network to be sparse, and at the same time remove any redundancies among the features to fully utilize the capacity of the network. Specifically, we propose to use an exclusive sparsity regularization based on (1,2)-norm, which promotes competition for features between different weights, thus enforcing them to fit to disjoint sets of features. We further combine the exclusive sparsity with the group sparsity based on (2,1)-norm, to promote both sharing and competition for features in training of a deep neural network. We validate our method on multiple public datasets, and the results show that our method can obtain more compact and efficient networks while also improving the performance over the base networks with full weights, as opposed to existing sparsity regularizations that often obtain efficiency at the expense of prediction accuracy.

We propose a novel learning framework for object categorization with interactive semantic feedback. In this framework, a discriminative categorization model improves through human-guided iterative semantic feedbacks. Specifically, the model identifies the most helpful relational semantic queries to discriminatively refine the model. The user feedback on whether the relationship is semantically valid or not is incorporated back into the model, in the form of regularization, and the process iterates. We validate the proposed model in a few-shot multi-class classification scenario, where we measure classification performance on a set of ‘target’ classes, with few training instances, by leveraging and transferring knowledge from ‘anchor’ classes, that contain larger set of labeled instances.

Viewpoint estimation, especially in case of multiple object classes, remains an important and challenging problem. First, objects under different views undergo extreme appearance variations, often making within-class variance larger than between-class variance. Second, obtaining precise ground truth for real-world images, necessary for training supervised viewpoint estimation models, is extremely difficult and time consuming. As a result, annotated data is often available only for a limited number of classes. Hence it is desirable to share viewpoint information across classes. Additional complexity arises from unaligned pose labels between classes, i.e. a side view of a car might look more like a frontal view of a toaster, than its side view. To address these problems, we propose a metric learning approach for joint class prediction and pose estimation. Our approach allows to circumvent the problem of viewpoint alignment across multiple classes, and does not require dense viewpoint labels. Moreover, we show, that the learned metric generalizes to new classes, for which the pose labels are not available, and therefore makes it possible to use only partially annotated training sets, relying on the intrinsic similarities in the viewpoint manifolds. We evaluate our approach on two challenging multi-class datasets, 3DObjects and PASCAL3D+.

Over the last several years it has been shown that image-based object detectors are sensitive to the training data and often fail to generalize to examples that fall outside the original training sample domain (e.g., videos). A number of domain adaptation (DA) techniques have been proposed to address this problem. DA approaches are designed to adapt a fixed complexity model to the new (e.g., video) domain. We posit that unlabeled data should not only allow adaptation, but also improve (or at least maintain) performance on the original and other domains by dynamically adjusting model complexity and parameters. We call this notion domain expansion. To this end, we develop a new scalable and accurate incremental object detection algorithm, based on several extensions of large-margin embedding (LME). Our detection model consists of an embedding space and multiple class prototypes in that embedding space, that represent object classes; distance to those prototypes allows us to reason about multi-class detection. By incrementally detecting object instances in video and adding confident detections into the model, we are able to dynamically adjust the complexity of the detector over time by instantiating new prototypes to span all domains the model has seen. We test performance of our approach by expanding an object detector trained on ImageNet to detect objects in egocentric videos of Activity Daily Living (ADL) dataset and challenging videos from YouTube Objects (YTO) dataset.

In multi-class categorization tasks, knowledge about the classes’ semantic relationships can provide valuable information beyond the class labels themselves. However, existing techniques focus on preserving the semantic distances between classes (e.g., according to a given object taxonomy for visual recognition), limiting the influence to pairwise structures. We propose to model \emphanalogies that reflect the relationships between multiple pairs of classes simultaneously, in the form “p is to q, as r is to s"". We translate semantic analogies into higher-order geometric constraints called \emphanalogical parallelograms, and use them in a novel convex regularizer for a discriminatively learned label embedding. Furthermore, we show how to discover analogies from attribute-based class descriptions, and how to prioritize those likely to reduce inter-class confusion. Evaluating our Analogy-preserving Semantic Embedding (ASE) on two visual recognition datasets, we demonstrate clear improvements over existing approaches, both in terms of recognition accuracy and analogy completion.

When learning features for complex visual recognition problems, labeled image exemplars alone can be insufficient. While an \emph{object taxonomy} specifying the categories' semantic relationships could bolster the learning process, not all relationships are relevant to a given visual classification task, nor does a single taxonomy capture all ties that \emph{are} relevant. In light of these issues, we propose a discriminative feature learning approach that leverages \emph{multiple} hierarchical taxonomies representing different semantic views of the object categories (e.g., for animal classes, one taxonomy could reflect their phylogenic ties, while another could reflect their habitats). For each taxonomy, we first learn a tree of semantic kernels, where each node has a Mahalanobis kernel optimized to distinguish between the classes in its children nodes. Then, using the resulting \emph{semantic kernel forest}, we learn class-specific kernel combinations to select only those relationships relevant to recognize each object class. To learn the weights, we introduce a novel hierarchical regularization term that further exploits the taxonomies' structure. We demonstrate our method on challenging object recognition datasets, and show that interleaving multiple taxonomic views yields significant accuracy improvements.

Current uses of tagged images typically exploit only the most explicit information: the link between the nouns named and the objects present somewhere in the image. We propose to leverage "unspoken" cues that rest within an ordered list of image tags so as to improve object localization. We define three novel implicit features from an image's tags-the relative prominence of each object as signified by its order of mention, the scale constraints implied by unnamed objects, and the loose spatial links hinted at by the proximity of names on the list. By learning a conditional density over the localization parameters (position and scale) given these cues, we show how to improve both accuracy and efficiency when detecting the tagged objects. Furthermore, we show how the localization density can be learned in a semantic space shared by the visual and tag-based features, which makes the technique applicable for detection in untagged input images. We validate our approach on the PASCAL VOC, LabelMe, and Flickr image data sets, and demonstrate its effectiveness relative to both traditional sliding windows as well as a visual context baseline. Our algorithm improves state-of-the-art methods, successfully translating insights about human viewing behavior (such as attention, perceived importance, or gaze) into enhanced object detection.

Visual attributes expose human-defined semantics to object recognition models, but existing work largely restricts their influence to mid-level cues during classifier training. Rather than treat attributes as intermediate features, we consider how learning visual properties in concert with object categories can regularize the models for both. Given a low-level visual feature space together with attribute-and object-labeled image data, we learn a shared lower-dimensional representation by optimizing a joint loss function that favors common sparsity patterns across both types of prediction tasks. We adopt a recent kernelized formulation of convex multi-task feature learning, in which one alternates between learning the common features and learning task-specific classifier parameters on top of those features. In this way, our approach discovers any structure among the image descriptors that is relevant to both tasks, and allows the top-down semantics to restrict the hypothesis space of the ultimate object classifiers. We validate the approach on datasets of animals and outdoor scenes, and show significant improvements over traditional multi-class object classifiers and direct attribute prediction models.

We introduce an approach to learn discriminative visual representations while exploiting external semantic knowledge about object category relationships. Given a hierarchical taxonomy that captures semantic similarity between the objects, we learn a corresponding tree of metrics (ToM). In this tree, we have one metric for each non-leaf node of the object hierarchy, and each metric is responsible for discriminating among its immediate subcategory children. Specifically, a Mahalanobis metric learned for a given node must satisfy the appropriate (dis)similarity constraints generated only among its subtree members' training instances. To further exploit the semantics, we introduce a novel regularizer coupling the metrics that prefers a sparse disjoint set of features to be selected for each metric relative to its ancestor supercategory nodes' metrics. Intuitively, this reflects that visual cues most useful to distinguish the generic classes (e.g., feline vs. canine) should be different than those cues most useful to distinguish their component fine-grained classes (e.g., Persian cat vs. Siamese cat). We validate our approach with multiple image datasets using the WordNet taxonomy, show its advantages over alternative metric learning approaches, and analyze the meaning of attribute features selected by our algorithm.

We introduce a method for image retrieval that leverages the implicit information about object importance conveyed by the list of keyword tags a person supplies for an image.We propose an unsupervised learning procedure based on Kernel Canonical Correlation Analysis that discovers the relationship between how humans tag images (e.g., the order in which words are mentioned) and the relative importance of objects and their layout in the scene.Using this discovered connection, we show how to boost accuracy for novel queries, such that the search results may more closely match the user's mental image of the scene being sought.We evaluate our approach on two datasets, and show clear improvements over both an approach relying on image features alone, as well as a baseline that uses words and image features, but ignores the implied importance cues.

Current uses of tagged images typically exploit only the most explicit information: the link between the nouns named and the objects present somewhere in the image. We propose to leverage “unspoken” cues that rest within an ordered list of image tags so as to improve object localization. We define three novel implicit features from an image's tags - the relative prominence of each object as signified by its order of mention, the scale constraints implied by unnamed objects, and the loose spatial links hinted by the proximity of names on the list. By learning a conditional density over the localization parameters (position and scale) given these cues, we show how to improve both accuracy and efficiency when detecting the tagged objects. We validate our approach with 25 object categories from the PASCAL VOC and LabelMe datasets, and demonstrate its effectiveness relative to both traditional sliding windows as well as a visual context baseline.