EDBT 2026 Demo / reviewers in the wild / expert
Andrea Spitaleri
dblp:150/3418
· DBLP profile ↗
1ranked-venue papers
0as first author
0since 2021 · last 2019
0000-0003-3012-3557ORCID · reported
Domains — the database's venue-derived domains; a paper can count in several
Applied, interdisciplinary, general and emerging computing · 1
Expertise — from the expertise taxonomy: the topics of the expert's papers under the CCF categories. A weight counts papers with recency: 1 for a paper about the topic, 0.3 when the topic is its context, halved every five years.
| Interdisciplinary, comprehensive, and emerging computing
1 paper |
Bioinformatics and computational biology · 91% Computational science and engineering · 9% |
Topics — the 4 heaviest of 5, each with the papers that count most for it
| Topic | Weight | Papers | Last | Evidence papers |
|---|---|---|---|---|
Bioinformatics and computational biology › structural bioinformatics › molecular structure analysis
molecular surface computation |
0.4 | 1 | 2019 | NanoShaper-VMD interface: computing and visualizing surfaces, pockets and channels in molecular systems · Bioinform. 2019 |
Bioinformatics and computational biology › molecular informatics
molecular visualization |
0.4 | 1 | 2019 | NanoShaper-VMD interface: computing and visualizing surfaces, pockets and channels in molecular systems · Bioinform. 2019 |
Bioinformatics and computational biology
structural bioinformatics |
0.4 | 1 | 2019 | NanoShaper-VMD interface: computing and visualizing surfaces, pockets and channels in molecular systems · Bioinform. 2019 |
Computational science and engineering
computational chemistry |
0.1 | 1 | 2019 | NanoShaper-VMD interface: computing and visualizing surfaces, pockets and channels in molecular systems · Bioinform. 2019 |
Methods — techniques the papers use, named apart from their topics
ray casting · 0.4analytical computation · 0.4
| Year | Publication | Venue | Position |
|---|---|---|---|
| 2019 | NanoShaper-VMD interface: computing and visualizing surfaces, pockets and channels in molecular systemsabstractSUMMARY: NanoShaper is a program specifically aiming the construction and analysis of the molecular surface of nanoscopic systems. It uses ray-casting for parallelism and it performs analytical computations whenever possible to maximize robustness and accuracy of the approach. Among the other features, NanoShaper provides volume, surface area, including that of internal cavities, for any considered molecular system. It identifies pockets via a very intuitive definition based on the concept of probe radius, intrinsic to the definition of the solvent excluded surface. We show here that, with a suitable choice of the parameters, the same approach can also permit the visualisation of molecular channels. NanoShaper has now been interfaced with the widely used molecular visualization software VMD, further enriching its already well furnished toolset. AVAILABILITY AND IMPLEMENTATION: VMD is available at http://www.ks.uiuc.edu/Research/vmd/. NanoShaper, its documentation, tutorials and supporting programs are available at http://concept.iit.it/downloads. SUPPLEMENTARY INFORMATION: Supplementary data are available at Bioinformatics online. Sergio Decherchi, Andrea Spitaleri, John E. Stone, Walter Rocchia |
Bioinform. | 2 |