Closed richardjgowers closed 1 year ago
test_ligand_network.py:264 (test_empty_ligand_network) mols = (SmallMoleculeComponent(name=), SmallMoleculeComponent(name=), SmallMoleculeComponent(name=)) def test_empty_ligand_network(mols): > n = LigandNetwork(edges=[], nodes=mols[0]) test_ligand_network.py:266: _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ ../tokenization.py:57: in __call__ instance = super().__call__(*args, **kwargs) _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ _ self = <[AttributeError("'LigandNetwork' object has no attribute '_nodes'") raised in repr()] LigandNetwork object at 0x7f540b397ac0> edges = [], nodes = SmallMoleculeComponent(name=) def __init__( self, edges: Iterable[LigandAtomMapping], nodes: Optional[Iterable[SmallMoleculeComponent]] = None ): if nodes is None: nodes = [] self._edges = frozenset(edges) print(edges) > edge_nodes = set.union(*[{edge.componentA, edge.componentB} for edge in edges]) E TypeError: unbound method set.union() needs an argument ../ligandnetwork.py:36: TypeError ========================= 1 failed, 1 warning in 0.07s ========================= Process finished with exit code 1