void buildRing()
Build the chemical structure for a ring molecule.
Classes used by all simpatico molecular simulations.
A Species of ring polymers (abstract).
Utility classes for scientific computation.
virtual int calculateAtomTypeId(int index) const =0
Return the atom type id for a specific atom.
virtual int calculateAngleTypeId(int index) const =0
Return the angle type id for a specific angle.
virtual int calculateDihedralTypeId(int index) const =0
Return the dihedral type id for a specific dihedral.
virtual int calculateBondTypeId(int index) const =0
Return the bond type id for a specific bond.
virtual ~Ring()
Destructor.
A Species represents a set of chemically similar molecules.