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Datasets:
molssiai-hub
/
pubchemqc-b3lyp
like
1
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MolSSI AI Hub
6
Tasks:
Tabular Regression
Other
Sub-tasks:
tabular-single-column-regression
Tags:
homo-lumo-gaps
energy
dipole-moments
quantum-chemistry
pubchem
small-molecules
License:
cc-by-4.0
Dataset card
Files
Files and versions
Community
1
db2567a
pubchemqc-b3lyp
/
data
/
b3lyp_pm6_chon300nosalt
1 contributor
History:
1 commit
smostafanejad
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5 months ago
train
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5 months ago