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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
xet
Community
protein_ligand_contacts
157 MB
  • 1 contributor
History: 16 commits
jglaser's picture
jglaser
fix import
9ec86e1 over 3 years ago
  • data
    add more cutoff distances over 3 years ago
  • README.md
    1.51 kB
    update script over 3 years ago
  • Untitled.ipynb
    1.74 kB
    add more cutoff distances over 3 years ago
  • pdbbind.ipynb
    23.1 kB
    update script over 3 years ago
  • pdbbind.py
    3.78 kB
    fix import over 3 years ago
  • pdbbind.slurm
    239 Bytes
    fix import over 3 years ago
  • protein_ligand_contacts.py
    5.74 kB
    add more cutoff distances over 3 years ago