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Datasets:
maltefranke
/
morph-data

Modalities:
3D
Languages:
English
ArXiv:
Tags:
chemistry
molecular-generation
3d
qm9
geom-drugs
chembl
Dataset card Files Files and versions
xet
Community
morph-data
105 GB
Ctrl+K
Ctrl+K
  • 1 contributor
History: 9 commits
maltefranke's picture
maltefranke
Add verified GEOM train libinvent scaffold cache
2a2a5ab verified 18 days ago
  • chembl3d
    Add processed QM9, GEOM-Drugs, and ChEMBL3D caches 24 days ago
  • chembl3d_max100
    Add processed QM9, GEOM-Drugs, and ChEMBL3D caches (part 2) 24 days ago
  • chembl3d_max100_implicit_h
    Add processed QM9, GEOM-Drugs, and ChEMBL3D caches (part 2) 24 days ago
  • geom
    Add verified GEOM train libinvent scaffold cache 18 days ago
  • qm9
    Add portable QM9 Murcko and heavy-atom scaffold caches 18 days ago
  • .gitattributes
    186 Bytes
    Add processed QM9, GEOM-Drugs, and ChEMBL3D caches 24 days ago
  • README.md
    6.51 kB
    Document downloads, model compatibility, and data checksums 24 days ago
  • SHA256SUMS
    6.58 kB
    Document downloads, model compatibility, and data checksums 24 days ago
  • manifest.json
    12.3 kB
    Document downloads, model compatibility, and data checksums 24 days ago