Datasets:

jglaser
/

pdb_protein_ligand_complexes

Tags:

complex structures

Dataset card Files Files and versions Community

pdb_protein_ligand_complexes / data /pdb.parquet

Commit History

add 2d conformers

1ee751f

jglaser commited on Apr 24, 2022

only retain first ligand if there are multiple copies

bc9f870

jglaser commited on Apr 9, 2022

Filter common ligands and ligands with <3 atoms

36d87d5

jglaser commited on Apr 5, 2022

initial commit

1d7245f

jglaser commited on Apr 1, 2022