MolecularDiffusion.modules.models.syncogen.api.graph.building_block¶

Classes¶

BuildingBlock

Building block.

Module Contents¶

class MolecularDiffusion.modules.models.syncogen.api.graph.building_block.BuildingBlock(smiles_or_mol_or_idx)¶

Building block.

get_atom_idx(center_idx)¶

is_mask = False¶

num_atoms¶