[ViewVC] Diff of: group/trunk/OOPSE/libmdtools/OOPSEMinimizer.cpp

Comparing trunk/OOPSE/libmdtools/OOPSEMinimizer.cpp (file contents):
Revision 1108 by tim, Wed Apr 14 15:37:41 2004 UTC vs.
Revision 1144 by tim, Sat May 1 18:52:38 2004 UTC

#	Line 4 \| Line 4 \| *OOPSEMinimizer::OOPSEMinimizer( SimInfo theInfo, Forc**
4		OOPSEMinimizer::OOPSEMinimizer( SimInfo theInfo, ForceFields the_ff ,
5		MinimizerParameterSet * param)
6		:RealIntegrator(theInfo, the_ff), bVerbose(false), bShake(true){
7	+	dumpOut = NULL;
8	+	statOut = NULL;
9
10		tStats = new Thermo(info);
11	<	dumpOut = new DumpWriter(info);
10	<	statOut = new StatWriter(info);
11	>
12
13		paramSet = param;
14
#	Line 21 \| Line 22 \| OOPSEMinimizer::~OOPSEMinimizer(){
22
23		OOPSEMinimizer::~OOPSEMinimizer(){
24		delete tStats;
25	<	delete dumpOut;
26	<	delete statOut;
25	>	if(dumpOut)
26	>	delete dumpOut;
27	>	if(statOut)
28	>	delete statOut;
29		delete paramSet;
30		}
31
#	Line 692 \| Line 695 \| void OOPSEMinimizer::minimize(){
695
696		if (bVerbose)
697		printMinimizerInfo();
698	+
699	+	dumpOut = new DumpWriter(info);
700	+	statOut = new StatWriter(info);
701
702		init();
703

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