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eve-bio/drug-target-activity
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Updated
Aug 14
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738k
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226
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41
unum-cloud/USearchMolecules
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about 1 month ago
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14B
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142
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2
jspc00012567/THBKG
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Aug 7
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28.8k
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102
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1
openadmet/cyp-challenge-train-test
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3 days ago
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35.5k
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2.64k
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9
iLOVE2D/sciagentarena_tb
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10 days ago
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138
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1
Infoton/An_Infoton_Dose_of_RxRx
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19 days ago
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442k
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134
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3
datamol-io/safe-gpt
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Jan 12
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1.17B
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3.15k
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4
tlemenestrel/Smiles2Dock
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Updated
Aug 21, 2025
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17.9M
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447
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1
gbyuvd/coconut-chembl34-selfies-mlm
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Sep 6, 2025
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270k
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145
gbyuvd/coconut-chembl34-mol-sim
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Sep 6, 2025
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1.17M
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62
gbyuvd/chembl34-hs221-drugtarget
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Sep 6, 2025
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221k
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62
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1
liuganghuggingface/Llamole-MolQA
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Oct 10, 2024
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128k
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112
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1
Metanova/SAVI-2020
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Sep 23, 2025
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3.49k
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2
vmsavla/ro4_vs_d2
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Apr 23, 2025
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15.5M
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64
jablonkagroup/chempile-mlift
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Jul 27, 2025
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51.5M
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21.5k
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14
jablonkagroup/chempile-lift
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Jan 12
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176M
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8.77k
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7
oxai4science/sagan-mc
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May 27, 2025
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423k
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70
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6
photonmz/pdbbindpp-2020
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220
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2
HydroSophyTech/ToxiMol-benchmark
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May 17
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660
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469
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2
Derify/pubchem_10m_genmol_similarity
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Sep 9, 2025
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21M
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76
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1
FuhaiLiAiLab/BioMedGraphica
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Mar 27
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835k
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145
summykai/chem-rlvr-TEST
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Jul 30, 2025
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7k
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148
summykai/chem-rlvr-TEST-2
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Jul 31, 2025
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10.4k
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104
summykai/chem-rlvr-TEST-3
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Jul 31, 2025
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16.7k
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76
summykai/chem-rlvr-TEST-4
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Updated
Jul 31, 2025
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16.7k
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124
gomesgroup/iron-mind-data
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Jun 22
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70
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1
summykai/chem-rlvr-TEST-5
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Aug 9, 2025
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16.7k
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78
molport/In-stock-Screening-Compound-Database
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Updated
19 days ago
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5.41M
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117
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1
Y-Tarl/BioGraphFusion
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Sep 22, 2025
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156k
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55
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1
hugging-science/awesome-food-allergy-datasets
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Updated
Oct 15, 2025
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72
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46
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