Bioinformatics | Computational Biology 3dDNAscoreA: a scoring function for evaluation of DNA 3D structures. February 27, 2024
Bioinformatics | Structural Biology lociPARSE: a locality-aware invariant point attention model for scoring RNA 3D structures. November 20, 2023
Bioinformatics | Computational Biology GDockScore: a graph-based protein-protein docking scoring function. June 26, 2023
Biomedical Engineering | Computational Chemistry A Small Step Toward Generalizability: Training a Machine Learning Scoring Function for Structure-Based Virtual Screening. May 11, 2023
Bioinformatics | Computational Biology | Drug Discovery ViTScore: a novel three-dimensional Vision Transformer method for accurate prediction of protein-ligand docking poses. May 9, 2023
Computer-Aided Drug Design | Machine Learning GB-score: Minimally designed machine learning scoring function based on distance-weighted interatomic contact features. February 1, 2023
Bioinformatics | Drug Discovery | Pharmacology Protein-Ligand Docking in the Machine-Learning Era. July 27, 2022
Bioinformatics | Computer-Aided Drug Design | Pharmacology Sfcnn: a novel scoring function based on 3D convolutional neural network for accurate and stable protein-ligand affinity prediction. June 8, 2022
Bioinformatics | Molecular Biology | Pharmacology Improving protein-ligand docking and screening accuracies by incorporating a scoring function correction term. March 15, 2022
Computer-Aided Drug Design | Pharmaceutical Sciences DockingApp RF: A State-of-the-Art Novel Scoring Function for Molecular Docking in a User-Friendly Interface to AutoDock Vina. December 18, 2020
Computational Chemistry | Drug Discovery | Neural Networks Convolutional Neural Network Based Virtual Screening. May 26, 2020