Dataset Viewer
The dataset viewer is not available because its heuristics could not detect any supported data files. You can try uploading some data files, or configuring the data files location manually.
PDBbind 2020 Refined Set
Curated collection of 5,316 high-quality protein-ligand complexes with experimentally measured binding affinity data from PDBbind v.2020 refined set.
Structure
- 5,316 directories named by PDB ID
- Each contains: protein.pdb, pocket.pdb, ligand.mol2, ligand.sdf
- Total size: ~2.7 GB
Citation
Liu, Z.H. et al. Acc. Chem. Res. 2017, 50, 302-309.
- Downloads last month
- 63