Semen Yesylevskyy
Latest publications
Sampling and Ranking of Protein Conformations Using Machine Learning Techniques Do Not Improve the Quality of Rigid Protein–Protein Docking
Journal of Chemical Information and Modeling 2025: Early View
Leveraging large language models for literature-driven prioritization of protein binding pockets
Bioinformatics 41 (8): btaf449 (2025)
Neural Network Models for Prediction of Biological Activity using Molecular Dynamics Data: A Case of Photoswitchable Peptides
Molecular Informatics 44 (7): e70001 (2025)
MolAR: Memory-Safe Library for Analysis of MD Simulations Written in Rust
Journal of Computational Chemistry 46 (1): e27536 (2025)