[ViewVC] Diff of: group/trunk/SHAPES/shaper.cpp

Comparing trunk/SHAPES/shaper.cpp (file contents):
Revision 1311 by gezelter, Thu Jun 24 15:31:52 2004 UTC vs.
Revision 1312 by chrisfen, Sat Jun 26 15:32:12 2004 UTC

#	Line 63 \| Line 63 \| *int main(int argc, char argv[]){**
63		double mass, rpar, eps;
64		double xyz3[3];
65		double moments[3][3];
66	+	double tolerance;
67		string fileName;
68		char vdwFileName[2002];
69		char structureFileName[2002];
#	Line 115 \| Line 116 \| *int main(int argc, char argv[]){**
116		//the bandwidth has a default value (default=16), so it is always given
117		bandwidth = args_info.bandwidth_arg;
118		gridwidth = bandwidth*2;
119	<
119	>
120	>	//the tolerance has a default value (default=0.01), so it is always given
121	>	tolerance = args_info.tolerance_arg;
122	>
123		if (args_info.charmm_given) {
124		FF=CHARMM;
125		strcpy(vdwFileName, "charmm27.vdw");

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