			/* -- c++ -- ----------------------------------------------------------
			LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
			http://lammps.sandia.gov, Sandia National Laboratories
			Steve Plimpton, sjplimp@sandia.gov

			Copyright (2003) Sandia Corporation. Under the terms of Contract
			DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains
			certain rights in this software. This software is distributed under
			the GNU General Public License.

			See the README file in the top-level LAMMPS directory.
			------------------------------------------------------------------------- */

			#ifndef LMP_NTOPO_H
			#define LMP_NTOPO_H

			#include "pointers.h"

			namespace LAMMPS_NS {

			class NTopo : protected Pointers {
			public:
			int nbondlist,nanglelist,ndihedrallist,nimproperlist;
			int bondlist,anglelist,dihedrallist,improperlist;

			NTopo(class LAMMPS *);
			virtual ~NTopo();

			virtual void build() = 0;

			bigint memory_usage();

			protected:
			enum{IGNORE,WARN,ERROR}; // same as thermo.cpp

			int me,nprocs;
			int maxbond,maxangle,maxdihedral,maximproper;
			int cluster_check; // copy from Neighbor

			void allocate_bond();
			void allocate_angle();
			void allocate_dihedral();
			void allocate_improper();

			void bond_check();
			void angle_check();
			void dihedral_check(int, int **);
			};

			}

			#endif

			/* ERROR/WARNING messages:

			*/

lammps/src/ntopo.h
2c93065786a1master

ntopo.h
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