stk.molecular.topology_graphs.topology_graph package
Subpackages
- stk.molecular.topology_graphs.topology_graph.construction_result package
- Submodules
- Construction Result
ConstructionResult- Periodic Construction Result
PeriodicConstructionResultPeriodicConstructionResult.__init__()PeriodicConstructionResult.get_atom_infos()PeriodicConstructionResult.get_atoms()PeriodicConstructionResult.get_bond_infos()PeriodicConstructionResult.get_bonds()PeriodicConstructionResult.get_building_blocks()PeriodicConstructionResult.get_num_building_block()PeriodicConstructionResult.get_periodic_info()PeriodicConstructionResult.get_position_matrix()
- Submodules
- stk.molecular.topology_graphs.topology_graph.construction_state package
- Subpackages
- Submodules
- Construction State
ConstructionStateConstructionState.__init__()ConstructionState.clone()ConstructionState.get_atom_infos()ConstructionState.get_atoms()ConstructionState.get_bond_infos()ConstructionState.get_bonds()ConstructionState.get_building_block()ConstructionState.get_building_blocks()ConstructionState.get_edge()ConstructionState.get_edge_group_functional_groups()ConstructionState.get_edges()ConstructionState.get_lattice_constants()ConstructionState.get_num_building_block()ConstructionState.get_num_edges()ConstructionState.get_num_vertices()ConstructionState.get_position_matrix()ConstructionState.get_vertices()ConstructionState.with_lattice_constants()ConstructionState.with_placement_results()ConstructionState.with_position_matrix()ConstructionState.with_reaction_results()ConstructionState.with_vertices()
- Graph State
- stk.molecular.topology_graphs.topology_graph.optimizers package
- stk.molecular.topology_graphs.topology_graph.topology_graph package