gmx_moltype_t Struct Reference

#include <gromacs/topology/topology.h>

Description

Molecules type data: atoms, interactions and exclusions.

Public Member Functions
gmx_moltype_t &	operator= (const gmx_moltype_t &)=delete
	Deleted copy assignment operator to avoid (not) freeing pointers.
	gmx_moltype_t (const gmx_moltype_t &)=default
	Default copy constructor.

Public Attributes
char **	name
	Name of the molecule type.
t_atoms	atoms
	The atoms in this molecule.
InteractionLists	ilist
	Interaction list with local indices.
t_block	cgs
	The charge groups.
t_blocka	excls
	The exclusions.

---

The documentation for this struct was generated from the following files:

• src/gromacs/topology/topology.h
• src/gromacs/topology/topology.cpp