Title | Description | Download link |
---|---|---|
Proteins (.pdbqt) | All protein structure files, including ACE2, spike protein, 3C-like protease (3CLpro), RNA-dependent RNA polymerase (RdRp), Papain-like protease (PLpro), nucleocapsid (N) protein, human angiotensin-converting enzyme 2 (ACE2) and transmembrane serine protease family member II (TMPRSS2). | protein.tar.gz |
Ligands (.pdbqt) | All ligand structure files and position information with best docking pose (best docking score). | best_pose.tar.gz |
Ligands with all poses (.pdbqt) | All ligand structure files and position information with all docking poses. | all_poses.tar.gz |