Datasets:

SupraBench
/

SupraDB-GEOM

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Tags:

supramolecular-chemistry

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Dataset card Data Studio Files Files and versions

SupraDB-GEOM / guests.csv

Commit History

Upload guests.csv with huggingface_hub

bcc5587
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mtybilly commited on 20 days ago

Upload guests.csv with huggingface_hub

18a3f9f
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mtybilly commited on 23 days ago

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

7199089
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mtybilly commited on 25 days ago

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

1053fff
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mtybilly commited on 25 days ago

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

7042585
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mtybilly commited on 26 days ago

Upload guests.csv with huggingface_hub

1d18d63
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mtybilly commited on 27 days ago