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Datasets

12
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Active filters: smiles

futurehouse/ether0-benchmark

Viewer • Updated 4 days ago • 325 • 504 • 6

zpn/zinc20

Preview • Updated Jan 6, 2023 • 195 • 12

alxfgh/PubChem10M_SELFIES

Viewer • Updated May 6, 2023 • 10M • 181

alxfgh/PubChem10M_SELFIES_Tokenized

Viewer • Updated Apr 30, 2023 • 4.99M • 10

pvrancx/tyk2_fep

Viewer • Updated Dec 30, 2023 • 10k • 29

Derify/augmented_canonical_pubchem_13m

Viewer • Updated Feb 22 • 13.3M • 71

Derify/augmented_canonical_druglike_QED_43M

Viewer • Updated Feb 22 • 42.8M • 38

Derify/safe_druglike_QED_33M

Viewer • Updated Feb 24 • 33.6M • 22

Derify/safe_pubchem_10m

Viewer • Updated Feb 24 • 10.2M • 30

karina-zadorozhny/ATOMICA

Viewer • Updated Apr 28 • 343k • 321

ChemFM/MolLangBench

Viewer • Updated 13 days ago • 33.2k • 182

Derify/pubchem_10m_genmol_similarity

Viewer • Updated 7 days ago • 19.5M • 99
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