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Datasets:
jglaser
/
protein_ligand_contacts

Modalities:
Tabular
Text
Size:
10K - 100K
Tags:
molecules
chemistry
SMILES
Libraries:
Datasets
Dataset card Data Studio Files Files and versions Community
protein_ligand_contacts
  • 1 contributor
History: 20 commits
jglaser's picture
jglaser
remove hetero atoms
67f9dbf about 3 years ago
  • data
    remove hetero atoms about 3 years ago
  • README.md
    1.52 kB
    fix two indexing bugs about 3 years ago
  • pdbbind.ipynb
    20.6 kB
    remove hetero atoms about 3 years ago
  • pdbbind.py
    3.94 kB
    remove hetero atoms about 3 years ago
  • pdbbind.slurm
    239 Bytes
    fix import about 3 years ago
  • protein_ligand_contacts.py
    5.82 kB
    fix loading script about 3 years ago