mdtools/headers/Molecule.hpp

#ifndef _MOLECULE_H_
#define _MOLECULE_H_

#include "Atom.hpp"
#include "SRI.hpp"

class Molecule{

public:
  
  Molecule() {}
  ~Molecule() {}

  int   getNMembers( void ) { return nMembers; }
  int   getStartAtom( void ) { return startAtom; }
  int   getEndAtom( void ) { return endAtom; }
  
  void   setNMembers( int info ) { nMembers = info; }
  void   setStartAtom( int info ) { startAtom = info; }
  void   setEndAtom( int info ) { endAtom = info; }
  

private:

  int nMembers;
  int startAtom;
  int endAtom;
  
};

#endif
Revision:	117
Committed:	Tue Sep 24 22:10:55 2002 UTC (23 years, 1 month ago) by mmeineke
File size:	533 byte(s)
Log Message:	fixed allot of warnings, and adde the molecule
#	Content
1	#ifndef _MOLECULE_H_
2	#define _MOLECULE_H_
3
4	#include "Atom.hpp"
5	#include "SRI.hpp"
6
7	class Molecule{
8
9	public:
10
11	Molecule() {}
12	~Molecule() {}
13
14	int getNMembers( void ) { return nMembers; }
15	int getStartAtom( void ) { return startAtom; }
16	int getEndAtom( void ) { return endAtom; }
17
18	void setNMembers( int info ) { nMembers = info; }
19	void setStartAtom( int info ) { startAtom = info; }
20	void setEndAtom( int info ) { endAtom = info; }
21
22
23	private:
24
25	int nMembers;
26	int startAtom;
27	int endAtom;
28
29	};
30
31	#endif