/* ---------------------------------------------------------------------- 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 IMPROPER_H #define IMPROPER_H #include "stdio.h" #include "pointers.h" namespace LAMMPS_NS { class Improper : protected Pointers { public: int allocated; int *setflag; double energy; double virial[6]; double PI; Improper(class LAMMPS *); virtual ~Improper() {} virtual void init(); virtual void compute(int, int) = 0; virtual void settings(int, char **) {} virtual void coeff(int, int, char **) = 0; virtual void write_restart(FILE *) = 0; virtual void read_restart(FILE *) = 0; virtual int memory_usage() {return 0;} }; } #endif