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molssiai-hub/pubchemqc-b3lyp
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Jul 22, 2025
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3.69k
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4
molssiai-hub/pubchemqc-pm6
Updated
Jul 22, 2025
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751
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1
molssiai-hub/pubchem-07-23-2024
Updated
Jul 22, 2025
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45
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1
molssiai-hub/pubchem-10-15-2024
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Jul 22, 2025
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379
molssiai-hub/pm7
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Updated
Nov 26, 2024
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4.62k
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30
Metanova/SAVI-2020
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Sep 23, 2025
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1.08k
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2
molssiai-hub/pubchem-02-21-2025
Updated
Jul 22, 2025
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87
molssiai-hub/pubchem-04-18-2025
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Updated
Mar 19
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324
molssiai-hub/liquid-electrolytes
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Updated
Jul 26, 2025
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362k
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25
Zhenghang04/DrugDiscovery_SMILES_Dataset
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25 days ago
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100
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3
aptabench-anonymous/AptaBench_dataset
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Updated
9 days ago
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6.29k
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44
tiny226/SAVI-2020-NOVA
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about 1 hour ago