Organic photovoltaic (OPV) materials offer a promising pathway for sustainable energy generation. However, their development is hindered by the challenge of identifying high-performance donor-acceptor pairs with optimal power conversion efficiencies (PCEs). Most existing design strategies focus exclusively on either the donor or the acceptor, rather than employing a unified model capable of designing both components. In this work, we introduce a dual-pronged machine learning framework for OPV discovery, integrating predictive modeling and generative molecular design. In this study, we propose the newly curated Organic Photovoltaic Donor-Acceptor Dataset (OPV²D), the largest of its kind, comprising 2,000 experimentally characterized donor-acceptor pairs. This dataset serves as a comprehensive foundation for model training and evaluation. To enable accurate property prediction in organic photovoltaic (OPV) materials, we first introduce the Organic Photovoltaic Classifier (OPVC) to predict the likelihood that a given material exhibits OPV behavior. Complementing this, we develop a hierarchical graph neural network framework that integrates multi-task learning and cross-modal donor–acceptor interaction modeling. This framework includes the Molecular Orbital Energy Estimator (MOE²) for predicting the highest occupied molecular orbital–lowest unoccupied molecular orbital (HOMO–LUMO) energy levels, and the Photovoltaic Performance Predictor (P³) for estimating power conversion efficiency (PCE). In addition, we introduce the Material Generative Pretrained Transformer (MatGPT) to generate synthetically accessible organic semiconductors. Building on this, we propose a reinforcement learning strategy with three-objective policy optimization that guides molecular generation while preserving chemical validity. By bridging molecular representation learning with device performance prediction, our framework advances computational OPV material discovery.

Accurate and reliable visualization of spatiotemporal sensor data such as environmental parameters and meteorological conditions is crucial for informed decision-making. Traditional spatial interpolation methods, however, often fall short of producing reliable interpolation results due to the limited and irregular sensor coverage. This paper introduces a novel spatial interpolation pipeline that achieves reliable interpolation results and produces a novel heatmap representation with uncertainty information encoded. We leverage imputation reference data from Graph Neural Networks (GNNs) to enhance visualization reliability and temporal resolution. By integrating Principal Neighborhood Aggregation (PNA) and Geographical Positional Encoding (GPE), our model effectively learns the spatiotemporal dependencies. Furthermore, we propose an extrinsic, static visualization technique for interpolation-based heatmaps that effectively communicates the uncertainties arising from various sources in the interpolated map. Through a set of use cases, extensive evaluations on real-world datasets, and user studies, we demonstrate our model's superior performance for data imputation, the improvements to the interpolant with reference data, and the effectiveness of our visualization design in communicating uncertainties.

The integration of visualizations and text is commonly found in data news, analytical reports, and interactive documents. For example, financial articles are presented along with interactive charts to show the changes in stock prices on Yahoo Finance. Visualizations enhance the perception of facts in the text while the text reveals insights of visual representation. However, effectively combining text and visualizations is challenging and tedious, which usually involves advanced programming skills. This paper proposes a semi-automatic pipeline that builds links between text and visualization. To resolve the relationship between text and visualizations, we present a method which structures a visualization and the underlying data as a contextual knowledge graph, based on which key phrases in the text are extracted, grouped, and mapped with visual elements. To support flexible customization of text-visualization links, our pipeline incorporates user knowledge to revise the links in a mixed-initiative manner. To demonstrate the usefulness and the versatility of our method, we replicate prior studies or cases in crafting interactive word-sized visualizations, annotating visualizations, and creating text-chart interactions based on a prototype system. We carry out two preliminary model tests and a user study and the results and user feedbacks suggest our method is effective.

High-quality data is critical to deriving useful and reliable information. However, real-world data often contains quality issues undermining the value of the derived information. Most existing research on data quality management focuses on tabular data, leaving semi-structured data under-exploited. Due to the schema-less and hierarchical features of semi-structured data, discovering and fixing quality issues is challenging and time-consuming. To address the challenge, this paper presents JsonCurer, an interactive visualization system to assist with data quality management in the context of JSON data. To have an overview of quality issues, we first construct a taxonomy based on interviews with data practitioners and a review of 119 real-world JSON files. Then we highlight a schema visualization that presents structural information, statistical features, and quality issues of JSON data. Based on a similarity-based aggregation technique, the visualization depicts the entire JSON data with a concise tree, where summary visualizations are given above each node, and quality issues are illustrated using Bubble Sets across nodes. We evaluate the effectiveness and usability of JsonCurer with two case studies. One is in the domain of data analysis while the other concerns quality assurance in MongoDB documents.

Images in visualization publications contain rich information, e.g., novel visualization designs and implicit design patterns of visualizations. A systematic collection of these images can contribute to the community in many aspects, such as literature analysis and automated tasks for visualization. In this paper, we build and make public a dataset, VisImages, which collects 12,267 images with captions from 1,397 papers in IEEE InfoVis and VAST. Built upon a comprehensive visualization taxonomy, the dataset includes 35,096 visualizations and their bounding boxes in the images. We demonstrate the usefulness of VisImages through three use cases: 1) investigating the use of visualizations in the publications with VisImages Explorer, 2) training and benchmarking models for visualization classification, and 3) localizing visualizations in the visual analytics systems automatically.

Data workers use various scripting languages for data transformation, such as SAS, R, and Python. However, understanding intricate code pieces requires advanced programming skills, which hinders data workers from grasping the idea of data transformation at ease. Program visualization is beneficial for debugging and education and has the potential to illustrate transformations intuitively and interactively. In this article, we explore visualization design for demonstrating the semantics of code pieces in the context of data transformation. First, to depict individual data transformations, we structure a design space by two primary dimensions, i.e., key parameters to encode and possible visual channels to be mapped. Then, we derive a collection of 23 glyphs that visualize the semantics of transformations. Next, we design a pipeline, named Somnus, that provides an overview of the creation and evolution of data tables using a provenance graph. At the same time, it allows detailed investigation of individual transformations. User feedback on Somnus is positive. Our study participants achieved better accuracy with less time using Somnus, and preferred it over carefully-crafted textual description. Further, we provide two example applications to demonstrate the utility and versatility of Somnus.

Data workers usually seek to understand the semantics of data wrangling scripts in various scenarios, such as code debugging, reusing, and maintaining. However, the understanding is challenging for novice data workers due to the variety of programming languages, functions, and parameters. Based on the observation that differences between input and output tables highly relate to the type of data transformation, we outline a design space including 103 characteristics to describe table differences. Then, we develop Comantics, a three-step pipeline that automatically detects the semantics of data transformation scripts. The first step focuses on the detection of table differences for each line of wrangling code. Second, we incorporate a characteristic-based component and a Siamese convolutional neural network-based component for the detection of transformation types. Third, we derive the parameters of each data transformation by employing a "slot filling" strategy. We design experiments to evaluate the performance of Comantics. Further, we assess its flexibility using three example applications in different domains.

In multiple coordinated views (MCVs), visualizations across views update their content in response to users' interactions in other views. Interactive systems provide direct manipulation to create coordination between views, but are restricted to limited types of predefined templates. By contrast, textual specification languages enable flexible coordination but expose technical burden. To bridge the gap, we contribute Nebula, a grammar based on natural language for coordinating visualizations in MCVs. The grammar design is informed by a novel framework based on a systematic review of 176 coordinations from existing theories and applications, which describes coordination by demonstration, i.e., how coordination is performed by users. With the framework, Nebula specification formalizes coordination as a composition of user- and coordination-triggered interactions in origin and destination views, respectively, along with potential data transformation between the interactions. We evaluate Nebula by demonstrating its expressiveness with a gallery of diverse examples and analyzing its usability on cognitive dimensions.

This article presents a new approach based on deep learning to automatically extract colormaps from visualizations. After summarizing colors in an input visualization image as a Lab color histogram, we pass the histogram to a pre-trained deep neural network, which learns to predict the colormap that produces the visualization. To train the network, we create a new dataset of ∼ 64K visualizations that cover a wide variety of data distributions, chart types, and colormaps. The network adopts an atrous spatial pyramid pooling module to capture color features at multiple scales in the input color histograms. We then classify the predicted colormap as discrete or continuous, and refine the predicted colormap based on its color histogram. Quantitative comparisons to existing methods show the superior performance of our approach on both synthetic and real-world visualizations. We further demonstrate the utility of our method with two use cases, i.e., color transfer and color remapping.

We design and evaluate a novel layout fine-tuning technique for node-link diagrams that facilitates exemplar-based adjustment of a group of substructures in batching mode. The key idea is to transfer user modifications on a local substructure to other substructures in the entire graph that are topologically similar to the exemplar. We first precompute a canonical representation for each substructure with node embedding techniques and then use it for on-the-fly substructure retrieval. We design and develop a light-weight interactive system to enable intuitive adjustment, modification transfer, and visual graph exploration. We also report some results of quantitative comparisons, three case studies, and a within-participant user study.

We present ShuttleSpace, an immersive analytics system to assist experts in analyzing trajectory data in badminton. Trajectories in sports, such as the movement of players and balls, contain rich information on player behavior and thus have been widely analyzed by coaches and analysts to improve the players' performance. However, existing visual analytics systems often present the trajectories in court diagrams that are abstractions of reality, thereby causing difficulty for the experts to imagine the situation on the court and understand why the player acted in a certain way. With recent developments in immersive technologies, such as virtual reality (VR), experts gradually have the opportunity to see, feel, explore, and understand these 3D trajectories from the player's perspective. Yet, few research has studied how to support immersive analysis of sports data from such a perspective. Specific challenges are rooted in data presentation (e.g., how to seamlessly combine 2D and 3D visualizations) and interaction (e.g., how to naturally interact with data without keyboard and mouse) in VR. To address these challenges, we have worked closely with domain experts who have worked for a top national badminton team to design ShuttleSpace. Our system leverages 1) the peripheral vision to combine the 2D and 3D visualizations and 2) the VR controller to support natural interactions via a stroke metaphor. We demonstrate the effectiveness of ShuttleSpace through three case studies conducted by the experts with useful insights. We further conduct interviews with the experts whose feedback confirms that our first-person immersive analytics system is suitable and useful for analyzing badminton data.

Group projects are an essential component of teaching user interface (UI) design. We identified six challenges in transferring traditional group projects into the context of Massive Open Online Courses: managing dropout, avoiding free-riding, appropriate scaffolding, cultural and time zone differences, and establishing common ground. We present a case study of the design of a group project for a UI Design MOOC, in which we implemented technical tools and social structures to cope with the above challenges. Based on survey analysis, interviews, and team chat data from the students over a six-month period, we found that our socio-technical design addressed many of the obstacles that MOOC learners encountered during remote collaboration. We translate our findings into design implications for better group learning experiences at scale.

Visual designs can be complex in modern data visualization systems, which poses special challenges for explaining them to the non-experts. However, few if any presentation tools are tailored for this purpose. In this study, we present Narvis, a slideshow authoring tool designed for introducing data visualizations to non-experts. Narvis targets two types of end users: teachers, experts in data visualization who produce tutorials for explaining a data visualization, and students, non-experts who try to understand visualization designs through tutorials. We present an analysis of requirements through close discussions with the two types of end users. The resulting considerations guide the design and implementation of Narvis. Additionally, to help teachers better organize their introduction slideshows, we specify a data visualization as a hierarchical combination of components, which are automatically detected and extracted by Narvis. The teachers craft an introduction slideshow through first organizing these components, and then explaining them sequentially. A series of templates are provided for adding annotations and animations to improve efficiency during the authoring process. We evaluate Narvis through a qualitative analysis of the authoring experience, and a preliminary evaluation of the generated slideshows.

Understanding team communication and collaboration patterns is critical for improving work efficiency in organizations. This paper presents an interactive visualization system, T-Cal, that supports the analysis of conversation data from modern team messaging platforms (e.g., Slack). T-Cal employs a user-familiar visual interface, a calendar, to enable seamless multi-scale browsing of data from different perspectives. T-Cal also incorporates a number of analytical techniques for disentangling interleaving conversations, extracting keywords, and estimating sentiment. The design of T-Cal is based on an iterative user-centered design process including interview studies, requirements gathering, initial prototypes demonstration, and evaluation with domain users. The resulting two case studies indicate the effectiveness and usefulness of T-Cal in real-world applications, including daily conversations within an industry research lab and student group chats in a MOOC.

Abstract With the rapid development of e‐commerce, there is an increasing number of online review websites, such as Yelp, to help customers make better purchase decisions. Viewing online reviews, including the rating score and text comments by other customers, and conducting a comparison between different businesses are the key to making an optimal decision. However, due to the massive amount of online reviews, the potential difference of user rating standards, and the significant variance of review time, length, details and quality, it is difficult for customers to achieve a quick and comprehensive comparison. In this paper, we present E‐Comp, a carefully‐designed visual analytics system based on online reviews, to help customers compare local businesses at different levels of details. More specifically, intuitive glyphs overlaid on maps are designed for quick candidate selection. Grouped Sankey diagram visualizing the rating difference by common customers is chosen for more reliable comparison of two businesses. Augmented word cloud showing adjective‐noun word pairs, combined with a temporal view, is proposed to facilitate in‐depth comparison of businesses in terms of different time periods, rating scores and features. The effectiveness and usability of E‐Comp are demonstrated through a case study and in‐depth user interviews.

User grouping in asynchronous online forums is a common phenomenon nowadays. People with similar backgrounds or shared interests like to get together in group discussions. As tens of thousands of archived conversational posts accumulate, challenges emerge for forum administrators and analysts to effectively explore user groups in large-volume threads and gain meaningful insights into the hierarchical discussions. Identifying and comparing groups in discussion threads are nontrivial, since the number of users and posts increases with time and noises may hamper the detection of user groups. Researchers in data mining fields have proposed a large body of algorithms to explore user grouping. However, the mining result is not intuitive to understand and difficult for users to explore the details. To address these issues, we present VisForum, a visual analytic system allowing people to interactively explore user groups in a forum. We work closely with two educators who have released courses in Massive Open Online Courses (MOOC) platforms to compile a list of design goals to guide our design. Then, we design and implement a multi-coordinated interface as well as several novel glyphs, i.e., group glyph, user glyph, and set glyph, with different granularities. Accordingly, we propose the group Detecting 8 Sorting Algorithm to reduce noises in a collection of posts, and employ the concept of “forum-index” for users to identify high-impact forum members. Two case studies using real-world datasets demonstrate the usefulness of the system and the effectiveness of novel glyph designs. Furthermore, we conduct an in-lab user study to present the usability of VisForum.

Whether and how does the structure of family trees differ by ancestral traits over generations? This is a fundamental question regarding the structural heterogeneity of family trees for the multi-generational transmission research. However, previous work mostly focuses on parent-child scenarios due to the lack of proper tools to handle the complexity of extending the research to multi-generational processes. Through an iterative design study with social scientists and historians, we develop TreeEvo that assists users to generate and test empirical hypotheses for multi-generational research. TreeEvo summarizes and organizes family trees by structural features in a dynamic manner based on a traditional Sankey diagram. A pixel-based technique is further proposed to compactly encode trees with complex structures in each Sankey Node. Detailed information of trees is accessible through a space-efficient visualization with semantic zooming. Moreover, TreeEvo embeds Multinomial Logit Model (MLM) to examine statistical associations between tree structure and ancestral traits. We demonstrate the effectiveness and usefulness of TreeEvo through an in-depth case-study with domain experts using a real-world dataset (containing 54,128 family trees of 126,196 individuals).

Discussion forums of Massive Open Online Courses (MOOC) provide great opportunities for students to interact with instructional staff as well as other students. Exploration of MOOC forum data can offer valuable insights for these staff to enhance the course and prepare the next release. However, it is challenging due to the large, complicated, and heterogeneous nature of relevant datasets, which contain multiple dynamically interacting objects such as users, posts, and threads, each one including multiple attributes. In this paper, we present a design study for developing an interactive visual analytics system, called iForum, that allows for effectively discovering and understanding temporal patterns in MOOC forums. The design study was conducted with three domain experts in an iterative manner over one year, including a MOOC instructor and two official teaching assistants. iForum offers a set of novel visualization designs for presenting the three interleaving aspects of MOOC forums (i.e., posts, users, and threads) at three different scales. To demonstrate the effectiveness and usefulness of iForum, we describe a case study involving field experts, in which they use iForum to investigate real MOOC forum data for a course on JAVA programming.

Massive Open Online Courses (MOOCs) platforms are becoming increasingly popular in recent years. With thousands of students watching course videos, enormous amounts of clickstream data are produced and recorded by the MOOCs platforms for each course. Such large-scale data provide a great opportunity for instructors and educational analysts to gain insight into online learning behaviors on an unprecedented scale. Nevertheless, the growing scale and unique characteristics of the data also pose a special challenge for effective data analysis. In this paper, we introduce VisMOOC, a visual analytic system to help analyze user learning behaviors by using video clickstream data from MOOC platforms. We work closely with the instructors of two Coursera courses to understand the data and collect task analysis requirements. A complete user-centered design process is further employed to design and develop VisMOOC. It includes three main linked views: the List View to show an overview of the clickstream differences among course videos, the Content-based View to show temporal variations in the total number of each type of click action along the video timeline, the Dashboard View to show various statistical information such as demographic information and temporal information. We conduct two case studies with the instructors to demonstrate the usefulness of VisMOOC and discuss new findings on learning behaviors.