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smiles
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futurehouse/ether0-benchmark
Viewer
•
Updated
Jun 24
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325
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300
•
15
zpn/zinc20
Preview
•
Updated
Jan 6, 2023
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364
•
15
alxfgh/PubChem10M_SELFIES
Viewer
•
Updated
May 6, 2023
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10M
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76
alxfgh/PubChem10M_SELFIES_Tokenized
Viewer
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Updated
Apr 30, 2023
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4.99M
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85
pvrancx/tyk2_fep
Viewer
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Updated
Dec 30, 2023
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10k
•
27
Derify/augmented_canonical_pubchem_13m
Viewer
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Updated
Sep 9
•
13.3M
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41
Derify/augmented_canonical_druglike_QED_43M
Viewer
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Updated
Sep 9
•
42.8M
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82
Derify/safe_druglike_QED_33M
Viewer
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Updated
Feb 24
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33.6M
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102
Derify/safe_pubchem_10m
Viewer
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Updated
Feb 24
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10.2M
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92
karina-zadorozhny/ATOMICA
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Updated
Apr 28
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343k
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108
jablonkagroup/chempile-mlift
Viewer
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Updated
Jul 27
•
51.5M
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4.71k
•
9
ChemFM/MolLangBench
Viewer
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Updated
10 days ago
•
34.6k
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276
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1
jablonkagroup/chempile-lift
Viewer
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Updated
Jul 26
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176M
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1.51k
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6
Derify/pubchem_10m_genmol_similarity
Viewer
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Updated
Sep 9
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21M
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242
Derify/druglike
Viewer
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Updated
Sep 9
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72M
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74
molport/In-stock-Database
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Updated
12 days ago
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5.91M
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186
molport/In-stock-Building-Block-Database
Viewer
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Updated
12 days ago
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858k
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51
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1
molport/In-stock-Screening-Compound-Database
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Updated
12 days ago
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5.32M
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147
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1
Derify/msr-acc-tae25-regression
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Updated
Sep 1
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76.4k
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31
Derify/augmented_canonical_druglike_QED_Pfizer_15M
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Updated
Sep 9
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15.4M
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84
molport/Drug-like-Compound-Library
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Updated
Sep 8
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2.14M
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7
Derify/antimalarial-classification
Viewer
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Updated
Sep 26
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4.79k
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20
Derify/cocrystal-classification
Viewer
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Updated
Sep 26
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1.48k
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34
Derify/covid-19-classification
Viewer
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Updated
Sep 26
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2.6k
•
25
gbyuvd/chemq3-molsim-sft-smiles
Viewer
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Updated
Oct 23
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777k
•
16
jeffdekerj/bms-images-shards
Updated
11 days ago
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13
jeffdekerj/bms-images-shards-256
Updated
10 days ago
•
11
nfsrulesFR/mega-moledit-522K
Viewer
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Updated
2 days ago
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1.04M
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27
nfsrulesFR/mega-moledit-large
Updated
2 days ago
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7