ChemistryAtlas Code
octavian-ganea/equidock_public
Docking and protein-ligand modelingGitHubsource codedeeplearningdockingdrug-discoverydrugdiscoveryequivarianceequivariant-networkequivariant-representationsgeometrygraphneuralnetwork
EquiDock: geometric deep learning for fast rigid 3D protein-protein docking
Why it is useful: Docking and protein-ligand modeling repository for chemistry, cheminformatics, molecular ML, simulation, synthesis, or drug discovery workflows.
GitHub signals: 257 stars, 59 forks, primary language: Roff.
Citation: GitHub repository: octavian-ganea/equidock_public