Popular GitHub Repositories for Protein Ligand

Target-aware Variational Auto-encoders for Ligand Generation with Multimodal Protein Representation Learning

SAnDReS (Statistical Analysis of Docking Results and Scoring functions) is a free and open-source computational environment for the development of machine-learning models for the prediction of ligand-binding affinity. We developed SAnDReS using Python programming language, and SciPy, NumPy, scikit-learn, and Matplotlib libraries as a computational