import os from dgllife.data import * def remove_file(fname): if os.path.isfile(fname): try: os.remove(fname) except OSError: pass def test_pubchem_aromaticity(): dataset = PubChemBioAssayAromaticity() remove_file('pubchem_aromaticity_dglgraph.bin') def test_tox21(): dataset = Tox21() remove_file('tox21_dglgraph.bin') def test_alchemy(): dataset = TencentAlchemyDataset(mode='valid', node_featurizer=None, edge_featurizer=None) dataset = TencentAlchemyDataset(mode='valid', node_featurizer=None, edge_featurizer=None, load=False) def test_pdbbind(): dataset = PDBBind(subset='core', remove_hs=True) if __name__ == '__main__': test_pubchem_aromaticity() test_tox21() test_alchemy() test_pdbbind()