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MoleculeNet
The MoleculeNet dataset is a collection of molecular property prediction tasks. It contains 17 datasets, each with a different type of molecular graph. -
Geom, energy-annotated molecular conformations for property prediction and mo...
Geom, energy-annotated molecular conformations for property prediction and molecular generation. -
Molecule Graph Dataset
The dataset used in the paper is a molecule graph dataset, which is used for molecule property prediction and generation tasks.