18#ifndef VOTCA_CSG_MOLECULEITEM_H
19#define VOTCA_CSG_MOLECULEITEM_H
37 assert(
mol_ !=
nullptr);
information about a base bead
void setMolecule(Molecule *mol)
MoleculeItem(Molecule *mol)
virtual ~MoleculeItem()=default
Molecule * getMolecule() const
information about molecules
base class for all analysis tools