trunk/SHAPES/PDBReader.hpp

#ifndef __PDBREADER_HPP__
#define __PDBREADER_HPP__

#include "VDWAtom.hpp"
#include <fstream>
#include <vector>
#include <zlib.h>

using namespace std;

class PDBReader {

public: 

  PDBReader(void);
  ~PDBReader(void);  
  void setPDBfile(const char*);
  vector<VDWAtom*> getAtomList(void);
  unsigned int getTotAtoms(void);
  char *TrimSpaces(char *str);

private:

  int done;  
  vector<VDWAtom*> theAtoms;
  int status; 
  gzFile PDBfile;
  
};

#endif

Revision:	1240
Committed:	Fri Jun 4 16:11:27 2004 UTC (20 years, 1 month ago) by gezelter
File size:	461 byte(s)
Log Message:	Initial import of SHAPES code
#	User	Rev	Content
1	gezelter	1240	#ifndef __PDBREADER_HPP__
2			#define __PDBREADER_HPP__
3
4			#include "VDWAtom.hpp"
5			#include <fstream>
6			#include <vector>
7			#include <zlib.h>
8
9			using namespace std;
10
11			class PDBReader {
12
13			public:
14
15			PDBReader(void);
16			~PDBReader(void);
17			void setPDBfile(const char*);
18			vector<VDWAtom*> getAtomList(void);
19			unsigned int getTotAtoms(void);
20			char TrimSpaces(char str);
21
22			private:
23
24			int done;
25			vector<VDWAtom*> theAtoms;
26			int status;
27			gzFile PDBfile;
28
29			};
30
31			#endif
32