[ViewVC] Diff of: group/trunk/mdtools/md

Comparing trunk/mdtools/md_code/SimInfo.cpp (file contents):
Revision 243 by mmeineke, Thu Jan 23 16:21:09 2003 UTC vs.
Revision 281 by chuckv, Mon Feb 24 21:25:15 2003 UTC

#	Line 1 \| Line 1
1		#include <cstdlib>
2
3		#include "SimInfo.hpp"
4	<
4	>	#define __C
5	>	#include "fsimulation.h"
6		extern "C"{
7		void wrapsimmod_( void (wrapFunction)(void (fSub)( int, double,
8		double, double)));
9		}
10
11	<	void wrapSimInfo((void (fSub)( int, double, double, double*)));
11	>	void wrapSimInfo(void (fSub)( int, double, double, double*));
12
13		SimInfo* currentInfo;
14
#	Line 31 \| Line 32 \| void SimInfo::wrapMe(){
32		wrapsimmod_( wrapSimInfo );
33		}
34
35	+
36		void SimInfo::refreshSim(){
37
38		double box[3];
#	Line 39 \| Line 41 \| void SimInfo::refreshSim(){
41		box[1] = box_y;
42		box[2] = box_z;
43
44	<	setFsimulation( &n_atoms, box, &rList, &rCut );
44	>
45	>
46	>	setFsimulation( &n_atoms, box, &rList, &rCut,&ensemble,
47	>	&mixingRule,&usePBC);
48		}
49
50
51	<	void wrapSimInfo((void (fSub)( int, double, double, double*))){
51	>	void wrapSimInfo(void (fSub)( int, double, double, double*)){
52
53		currentInfo->setInternal(fSub);
54		}

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