MoleculeNet

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MoleculeNet benchmark

load_moleculenet_benchmark	Load and return the MoleculeNet benchmark datasets.
load_ogb_splits	Load and return the MoleculeNet dataset splits from Open Graph Benchmark (OGB).

Dataset loaders

load_bace	Load and return the BACE dataset.
load_bbbp	Load and return the BBBP (Blood-Brain Barrier Penetration) dataset.
load_clintox	Load and return the ClinTox dataset.
load_esol	Load and return the ESOL (Estimated SOLubility) dataset.
load_freesolv	Load and return the FreeSolv (Free Solvation Database) dataset.
load_hiv	Load and return the HIV dataset.
load_lipophilicity	Load and return the Lipophilicity dataset.
load_muv	Load and return the MUV (Maximum Unbiased Validation) dataset.
load_pcba	Load and return the PCBA (PubChem BioAssay) dataset.
load_sider	Load and return the SIDER (Side Effect Resource) dataset.
load_tox21	Load and return the Tox21 dataset.
load_toxcast	Load and return the ToxCast dataset.