fix_ave_histo.h
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	/* ----------------------------------------------------------------------
	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 FIX_AVE_HISTO_H
	#define FIX_AVE_HISTO_H

	#include "stdio.h"
	#include "fix.h"

	namespace LAMMPS_NS {

	class FixAveHisto : public Fix {
	public:
	FixAveHisto(class LAMMPS , int, char *);
	~FixAveHisto();
	int setmask();
	void init();
	void setup(int);
	void end_of_step();
	double compute_vector(int);
	double compute_array(int,int);

	private:
	int me,nvalues;
	int nrepeat,nfreq,nvalid,irepeat;
	int which,argindex,*value2index;
	char **ids;
	FILE *fp;
	double lo,hi,binsize,bininv;
	int kind,beyond;

	double stats[4],stats_total[4],stats_all[4];

	int nbins;
	double bin,bin_total,*bin_all;
	double **bin_list;
	double *coord;

	double *vector;
	int maxatom;

	int ave,nwindow,nsum,startstep,mode;
	char title1,title2,*title3;
	int iwindow,window_limit;

	void bin_one(double);
	void bin_vector(int, double *, int);
	void bin_atoms(double *, int);
	void options(int, char **);
	};

	}

	#endif