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Datasets:
SupraBench
/
SupraDB-GEOM

Modalities:
Tabular
Text
Formats:
csv
Size:
100K - 1M
Tags:
chemistry
supramolecular-chemistry
rdkit
cb7
Libraries:
Datasets
pandas
Polars
License:
Dataset card Data Studio Files
xet
 Community
1
SupraDB-GEOM

Commit History

  1. Upload guests.csv with huggingface_hub

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  1. Upload guests.csv with huggingface_hub

    mtybilly
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    18a3f9f

  1. Upload README.md with huggingface_hub

    mtybilly
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    a6b3828

  2. Repair + add QM9: 430,904 guests w/ source+n_heavy

    mtybilly
    Verified signature
    7199089

  3. Add QM9: 430,904 guests (geom_drugs+qm9+labeled) w/ source + n_heavy

    mtybilly
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    1053fff

  4. Upload README.md with huggingface_hub

    mtybilly
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    7e33ba4

  5. Rebuild from full GEOM-drugs (304k SMILES) + 63 labeled merged

    mtybilly
    Verified signature
    7042585

  1. Upload README.md with huggingface_hub

    mtybilly
    Verified signature
    274ae62

  2. Upload guests.csv with huggingface_hub

    mtybilly
    Verified signature
    1d18d63

  3. initial commit

    mtybilly
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    b7f5618