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SupraBench/Binding-Affinity
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Updated
Jun 12
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2.61k
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70
SpectrumWorld/SA-MolNMR-SI-240K
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Updated
Jun 5
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212k
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40
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3
SpectrumWorld/SA-MolNMR-Exp-1M
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Updated
Jun 5
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1.17M
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49
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1
PatSnap/hiro-ocsr-real-24k
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Updated
Jul 23
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24.7k
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17
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5
EarthMetabolomeInitiative/lots-of-smiles
Updated
Jun 22
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111
ZemResearch/HippoCrates
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Updated
Jul 1
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1.46M
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8
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1
ZemResearch/HippoXic
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Updated
Jul 1
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10.6k
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16
ZemResearch/HippoLv
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Updated
Jul 1
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9.47k
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14
ZemResearch/HippoSynth
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Updated
Jul 2
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50k
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19
ZemResearch/HippoTarget
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Updated
Jul 4
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15.5k
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14
zzha6204/CheMM-Bench
Preview
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Updated
Jul 15
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38
zzha6204/CheMM-Train
Preview
•
Updated
Jul 15
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57
•
1
nadizik/3D_Synthetic_Petroleum_Derived_GEMS
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Updated
Jul 15
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197
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8
lukaskim/cadd-instruct-raw
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Updated
Jul 23
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15.6M
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183
InfoBayAI/SMILES-QA-Dataset
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Updated
3 days ago
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3
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114
lukaskim/cadd-instruct-v1
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Updated
Jul 27
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15.6M
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93
Dinesh4311/drugage-lifespan-benchmark
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Updated
Jul 31
•
754
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42
unum-cloud/USearchMolecules
Viewer
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Updated
Aug 27
•
14B
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61
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2
Jainamshahhh/molperceive
Viewer
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Updated
Aug 9
•
90k
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255
hheiden/molecular-depiction-pairs-20k
Viewer
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Updated
Aug 2
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39.9k
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22
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1
lsieben/climb-pretrain-data
Viewer
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Updated
12 days ago
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34.3k
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997
Bilsteen/PubChem-124M-SMILES-SELFIES-InChI-IUPAC
Viewer
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Updated
Aug 13
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123M
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296
AlexanderWang915/MolOptIns
Preview
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Updated
Sep 4
•
42
yaniguan/ocsr-dataset
Viewer
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Updated
28 days ago
•
18.4k
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88
woongworks/aqsoldb-ml-ready-preview
Viewer
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Updated
4 days ago
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200
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99
structure-epflai/spectra-molecule-registry
Viewer
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Updated
10 days ago
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113M
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747
woongworks/freesolv-ml-ready-preview
Viewer
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Updated
4 days ago
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150
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66
woongworks/qm9-ml-ready-preview
Viewer
•
Updated
4 days ago
•
150
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57
woongworks/biogen-adme-ml-ready-preview
Viewer
•
Updated
4 days ago
•
150
•
71
woongworks/openadmet-cyp-ml-ready-preview
Viewer
•
Updated
4 days ago
•
150
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66
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