trunk/SHAPES/SphereHarm.hpp

#ifndef __SPHEREHARM_HPP__
#define __SPHEREHARM_HPP__

#include <errno.h>
#include <math.h>
#include <stdio.h>
#include <stdlib.h>
#include <string.h>
#include <vector>
#include <iostream>
#include <fstream>

#include "fftw3.h"
#include "cospmls.h"
#include "makeweights.h"
#include "FST_semi_memo.h"
#include "SHFunc.hpp"

using namespace std;

class SphereHarm{
  
public:
  SphereHarm( int bandWidth );
  virtual ~SphereHarm();
  void doTransforms(vector<double> gridData);
  void printShapesFileStart(char name[200], char particle[80], double mass,
                            double momInert[3][3]);
  void printShapesStreamStart(ostream& shapes, char particle[80], double mass,
                              double momInert[3][3]);
  void printToShapesFile(char name[200], int index, double tolVal);
  void printToShapesStream(ostream& shapes, int index, double tolVal);
  double normFactor(int L, int M);
  double factorialFunc(double n);

protected:
  int l, m;
  int dummy1, dummy2, nfuncs;
  
  int bw, size;
  int cutoff, order;
  int rank, howmany_rank;
  double *rdata, *idata;
  double *rcoeffs, *icoeffs;
  double *weights;
  double *seminaive_naive_tablespace, *workspace;
  double **seminaive_naive_table;
  double tstart, tstop;
  double biggest, cm, sm;
  fftw_plan dctPlan, fftPlan;
  fftw_iodim dims[1], howmany_dims[1];
  
};

#endif
Revision:	1360
Committed:	Tue Jul 20 20:02:15 2004 UTC (21 years, 3 months ago) by gezelter
File size:	1356 byte(s)
Log Message:	Changes for CGI and for gengetopts --unamed-opt="PDBFILE"
#	User	Rev	Content
1	chrisfen	1287	#ifndef __SPHEREHARM_HPP__
2			#define __SPHEREHARM_HPP__
3
4			#include <errno.h>
5			#include <math.h>
6			#include <stdio.h>
7			#include <stdlib.h>
8			#include <string.h>
9			#include <vector>
10			#include <iostream>
11			#include <fstream>
12
13			#include "fftw3.h"
14	chrisfen	1289	#include "cospmls.h"
15			#include "makeweights.h"
16			#include "FST_semi_memo.h"
17	chrisfen	1309	#include "SHFunc.hpp"
18	chrisfen	1287
19			using namespace std;
20
21			class SphereHarm{
22
23			public:
24			SphereHarm( int bandWidth );
25			virtual ~SphereHarm();
26			void doTransforms(vector<double> gridData);
27	chrisfen	1292	void printShapesFileStart(char name[200], char particle[80], double mass,
28	chrisfen	1287	double momInert[3][3]);
29	gezelter	1360	void printShapesStreamStart(ostream& shapes, char particle[80], double mass,
30			double momInert[3][3]);
31	chrisfen	1313	void printToShapesFile(char name[200], int index, double tolVal);
32	gezelter	1360	void printToShapesStream(ostream& shapes, int index, double tolVal);
33	chrisfen	1309	double normFactor(int L, int M);
34			double factorialFunc(double n);
35	chrisfen	1287
36			protected:
37			int l, m;
38			int dummy1, dummy2, nfuncs;
39
40			int bw, size;
41			int cutoff, order;
42			int rank, howmany_rank;
43			double rdata, idata;
44			double rcoeffs, icoeffs;
45			double *weights;
46			double seminaive_naive_tablespace, workspace;
47			double **seminaive_naive_table;
48			double tstart, tstop;
49			double biggest, cm, sm;
50			fftw_plan dctPlan, fftPlan;
51			fftw_iodim dims[1], howmany_dims[1];
52
53			};
54
55	chrisfen	1288	#endif