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We introduce LAVIS, an open-source deep learning library for LAnguage-VISion research and applications. LAVIS aims to serve as a one-stop comprehensive library that brings recent advancements in the language-vision field accessible for…

Computer Vision and Pattern Recognition · Computer Science 2022-09-20 Dongxu Li , Junnan Li , Hung Le , Guangsen Wang , Silvio Savarese , Steven C. H. Hoi

Aberrant protein-protein interactions (PPIs) underpin a plethora of human diseases, and disruption of these harmful interactions constitute a compelling treatment avenue. Advances in computational approaches to PPI prediction have closely…

Biomolecules · Quantitative Biology 2025-07-29 François Charih , James R. Green , Kyle K. Biggar

Psychological research often involves understanding psychological constructs through conducting factor analysis on data collected by a questionnaire, which can comprise hundreds of questions. Without interactive systems for interpreting…

Human-Computer Interaction · Computer Science 2024-08-06 Yikai Lu , Chaoli Wang

The promise of multimodal models for real-world applications has inspired research in visualizing and understanding their internal mechanics with the end goal of empowering stakeholders to visualize model behavior, perform model debugging,…

Protein-protein interactions drive many biological processes, including the detection of phytopathogens by plants' R-Proteins and cell surface receptors. Many machine learning studies have attempted to predict protein-protein interactions…

Machine Learning · Computer Science 2023-10-24 Ruth Veevers , Dan MacLean

One of the most difficult problems difficult problem in systems biology is to discover protein-protein interactions as well as their associated functions. The analysis and alignment of protein-protein interaction networks (PPIN), which are…

Molecular Networks · Quantitative Biology 2019-02-20 Ricardo Alberich , Adrià Alcala , Mercè Llabrés , Francesc Rosselló , Gabriel Valiente

We participated, in the Article Classification and the Interaction Method subtasks (ACT and IMT, respectively) of the Protein-Protein Interaction task of the BioCreative III Challenge. For the ACT, we pursued an extensive testing of…

Quantitative Methods · Quantitative Biology 2011-04-25 Anália Lourenço , Michael Conover , Andrew Wong , Azadeh Nematzadeh , Fengxia Pan , Hagit Shatkay , Luis M. Rocha

Understanding and visualizing the full-stack performance trade-offs and interplay between HPC applications, MPI libraries, the communication fabric, and the file system is a challenging endeavor. Designing a holistic profiling and…

Graphics · Computer Science 2021-09-20 Pouya Kousha , Quentin Anthony , Hari Subramoni , Dhabaleswar K. Panda

We propose a novel method for the determination of the effective interaction potential between the amino acids of a protein. The strategy is based on the combination of a new optimization procedure and a geometrical argument, which also…

Soft Condensed Matter · Physics 2009-10-31 Jort van Mourik , Cecilia Clementi , Amos Maritan , Flavio Seno , J. R. Banavar

We explore the interplay between the protein-protein interactions network and the expression of the interacting proteins. It is shown that interacting proteins are expressed in significantly more similar cellular concentrations. This is…

Molecular Networks · Quantitative Biology 2007-05-23 Shai Carmi , Erez Y. Levanon , Shlomo Havlin , Eli Eisenberg

Many complex systems can be represented as networks composed by distinct layers, interacting and depending on each others. For example, in biology, a good description of the full protein-protein interactome requires, for some organisms, up…

Physics and Society · Physics 2015-04-24 M. De Domenico , V. Nicosia , A. Arenas , V. Latora

Protein-protein interactions (PPIs) are governed by surface complementarity and hydrophobic interactions at protein interfaces. However, designing diverse and physically realistic protein structure and surfaces that precisely complement…

Machine Learning · Computer Science 2025-11-24 Guanlue Li , Xufeng Zhao , Fang Wu , Sören Laue

We report on a systematic, PRISMA-guided survey of research at the intersection of LLMs and visualization, with a particular focus on visio-verbal interaction -- where verbal and visual modalities converge to support data sense-making. The…

Human-Computer Interaction · Computer Science 2026-02-04 Mathis Brossier , Tobias Isenberg , Konrad Schönborn , Jonas Unger , Mario Romero , Johanna Björklund , Anders Ynnerman , Lonni Besançon

This paper examines how different types of large language model (LLM) agents perform on scientific visualization (SciVis) tasks, where users generate visualization workflows from natural-language instructions. We compare three primary…

Artificial Intelligence · Computer Science 2026-05-14 Jackson Vonderhorst , Kuangshi Ai , Haichao Miao , Shusen Liu , Chaoli Wang

Biocatalysis is a promising approach to sustainably synthesize pharmaceuticals, complex natural products, and commodity chemicals at scale. However, the adoption of biocatalysis is limited by our ability to select enzymes that will catalyze…

Biomolecules · Quantitative Biology 2022-04-06 Samuel Goldman , Ria Das , Kevin K. Yang , Connor W. Coley

Nanomaterial-protein interactions (NPI) are pivotal to realizing the therapeutic and diagnostic potential of nanomaterials. Although AI promises to accelerate mechanistic understanding and enable rational nanomaterial design, robust…

Machine Learning · Computer Science 2026-04-29 Hengjie Yu , Kenneth A. Dawson , Haiyun Yang , Shuya Liu , Yan Yan , Yaochu Jin

Protein-protein interaction (PPI) networks consist of the physical and/or functional interactions between the proteins of an organism. Since the biophysical and high-throughput methods used to form PPI networks are expensive,…

Developing and discovering new drugs is a complex and resource-intensive endeavor that often involves substantial costs, time investment, and safety concerns. A key aspect of drug discovery involves identifying novel drug-target (DT)…

Machine Learning · Computer Science 2024-02-13 Rakesh Bal , Yijia Xiao , Wei Wang

Many expressive visualizations are shared online only as bitmap images, making them difficult to redesign or adapt to new data. Reusing such image-based visualizations requires substantial expertise and is often time-consuming, even for…

Human-Computer Interaction · Computer Science 2026-04-20 Xiaolin Wen , Changlin Li , Manusha Karunathilaka , Can Liu , Fangzhuo Jin , Yong Wang

As machine learning becomes more pervasive, there is an urgent need for interpretable explanations of predictive models. Prior work has developed effective methods for visualizing global model behavior, as well as generating local…

Machine Learning · Computer Science 2019-04-02 Matthew Britton