Active filters: smiles
PatSnap/hiro-ocsr-real-24k
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• Updated • 24.7k • 17
• 5
Preview
• Updated • 392
• 15
alxfgh/PubChem10M_SELFIES
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• Updated • 10M • 148
• 1
alxfgh/PubChem10M_SELFIES_Tokenized
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• Updated • 4.99M • 39
• 2
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• Updated • 1.17B • 2.44k
• 4
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• Updated • 10k • 36
Derify/augmented_canonical_pubchem_13m
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• Updated • 13.3M • 42
Derify/augmented_canonical_druglike_QED_43m
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• Updated • 42.8M • 43
• 1
Derify/safe_druglike_QED_33m
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• Updated • 33.6M • 83
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• Updated • 10.2M • 55
karina-zadorozhny/ATOMICA
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• Updated • 343k • 7.32k
jablonkagroup/chempile-mlift
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• Updated • 51.5M • 20.7k
• 14
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• Updated • 34.6k • 238
• 2
jablonkagroup/chempile-lift
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• Updated • 176M • 8.44k
• 7
Derify/pubchem_10m_genmol_similarity
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• Updated • 21M • 74
• 1
futurehouse/ether0-benchmark
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• Updated • 325 • 3.8k
• 17
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• Updated • 72M • 30
molport/In-stock-Database
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• Updated • 6.27M • 105
molport/In-stock-Building-Block-Database
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• Updated • 1.25M • 91
• 1
molport/In-stock-Screening-Compound-Database
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• Updated • 5.41M • 65
• 1
Derify/msr-acc-tae25-regression
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• Updated • 76.4k • 25
Derify/augmented_canonical_druglike_QED_Pfizer_15m
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• Updated • 15.4M • 38
• 1
molport/Drug-like-Compound-Library
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• Updated • 2.14M • 5
Derify/antimalarial-classification
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• Updated • 4.79k • 25
Derify/cocrystal-classification
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• Updated • 1.48k • 17
Derify/covid-19-classification
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• Updated • 2.6k • 10
gbyuvd/chemq3-molsim-sft-smiles
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• Updated • 777k • 65
summykai/chemistry-sft-ultra
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• Updated • 1.37M • 175
• 4
jeffdekerj/bms-images-shards
Updated • 90
jeffdekerj/bms-images-shards-256
Updated • 15