assembleMolecule(System &molecule_sys, vector< vector< vector< Atom * > > > &ringsystems, vector< vector< Atom * > > &chains) | MoleculeAssembler | |
compareRingsystems(const vector< vector< Atom * > > &x, const vector< vector< Atom * > > &y) | MoleculeAssembler | [static] |
MoleculeAssembler() | MoleculeAssembler | |
~MoleculeAssembler() | MoleculeAssembler |