OOPSE/libmdtools/ZConsReader.hpp

#ifndef _ZCONSREADER_H_
#define _ZCONSREADER_H_

#include <fstream>
#include <string>
#include <vector>

#include "Integrator.hpp"
#include "SimInfo.hpp"

using namespace std;

class ZConsReader{
  public:
    
    ZConsReader(SimInfo* info);
    ~ZConsReader();
    
    void readHeader();
    void readNextFrame();
    bool hasNextFrame();
    int getNumZMol();
    vector<int> getZConsIndex();
    vector<double> getZConsPos();
    //vector<double> getKRatio();
    
    vector<double> getCurZPos(); 
    vector<double> getCurFZ();
    double getCurTime();

  private:
    ifstream* istream;    
    SimInfo* info;
    string zconsFileName;

    int nZMol;
    vector<int> index;
    vector<double> zconsPos;
    //vector<double> kRatio;

    double curTime;    
    vector<double> curFZ;
    vector<double> curZPos;

};

#endif
Revision:	1074
Committed:	Mon Mar 1 20:01:50 2004 UTC (20 years, 4 months ago) by tim
File size:	879 byte(s)
Log Message:	Adding zsub, a program which can be used to replace atom type for zconstraint into OOPSE
#	User	Rev	Content
1	tim	1074	#ifndef _ZCONSREADER_H_
2			#define _ZCONSREADER_H_
3
4			#include <fstream>
5			#include <string>
6			#include <vector>
7
8			#include "Integrator.hpp"
9			#include "SimInfo.hpp"
10
11			using namespace std;
12
13			class ZConsReader{
14			public:
15
16			ZConsReader(SimInfo* info);
17			~ZConsReader();
18
19			void readHeader();
20			void readNextFrame();
21			bool hasNextFrame();
22			int getNumZMol();
23			vector<int> getZConsIndex();
24			vector<double> getZConsPos();
25			//vector<double> getKRatio();
26
27			vector<double> getCurZPos();
28			vector<double> getCurFZ();
29			double getCurTime();
30
31			private:
32			ifstream* istream;
33			SimInfo* info;
34			string zconsFileName;
35
36			int nZMol;
37			vector<int> index;
38			vector<double> zconsPos;
39			//vector<double> kRatio;
40
41			double curTime;
42			vector<double> curFZ;
43			vector<double> curZPos;
44
45			};
46
47			#endif