[ViewVC] Diff of: OpenMD/trunk/src/applications/randomBuilder/randomBuilder.cpp

Comparing trunk/src/applications/randomBuilder/randomBuilder.cpp (file contents):
Revision 1065 by gezelter, Tue Oct 10 14:52:20 2006 UTC vs.
Revision 1077 by gezelter, Wed Oct 18 19:35:07 2006 UTC

#	Line 42 \| Line 42
42		*
43		* Created by Charles F. Vardeman II on 10 Apr 2006.
44		* @author Charles F. Vardeman II
45	<	* @version $Id: randomBuilder.cpp,v 1.5 2006-10-10 14:52:20 gezelter Exp $
45	>	* @version $Id: randomBuilder.cpp,v 1.7 2006-10-18 19:35:07 gezelter Exp $
46		*
47		*/
48
#	Line 105 \| Line 105 \| *int main(int argc, char argv []) {**
105		density = args_info.density_arg;
106
107		//get lattice type
108	<	latticeType = UpperCase(args_info.latticetype_arg);
108	>	latticeType = "FCC";
109
110		simpleLat = LatticeFactory::getInstance()->createLattice(latticeType);
111
#	Line 388 \| Line 388 \| void createMdFile(const std::string&oldMdFileName,
388
389		oldMdFile.close();
390		newMdFile.close();
391	+
392	+	if (i != nMol.size()) {
393	+	sprintf(painCave.errMsg, "Couldn't replace the correct number of nMol\n"
394	+	"\tstatements in component blocks. Make sure that all\n"
395	+	"\tcomponents in the template file have nMol=1");
396	+	painCave.isFatal = 1;
397	+	simError();
398	+	}
399	+
400		}
401

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