Datasets:
maomlab
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Molecule3D
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Molecule3D_random_split
·
3.9M rows
Molecule3D_random_split (3.9M rows)
Molecule3D_scaffold_split (3.9M rows)
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train
·
2.34M rows
train (2.34M rows)
validation (780k rows)
test (780k rows)
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