BioinformaticsbioRxivPreprint
ApoDock: Ligand-Conditioned Sidechain Packing for Flexible Molecular Docking
Ding Luo, Xiaoyang Qu, Dexin Lu…·Binju Wang
ApoDock improves molecular docking by combining machine learning-driven sidechain packing with traditional sampling to generate physically plausible protein-ligand poses.