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

Comparing trunk/mdtools/interface_implementation/SimSetup.cpp (file contents):
Revision 253 by chuckv, Thu Jan 30 15:20:21 2003 UTC vs.
Revision 254 by chuckv, Thu Jan 30 20:03:37 2003 UTC

#	Line 238 \| Line 238 \| void SimSetup::createSim( void ){
238
239		mpiSim = new mpiSimulation( simnfo );
240
241	+	fprintf( stderr, "about to call divideLabour.\n" );
242	+
243		globalIndex = mpiSim->divideLabor();
244
245	+	fprintf(stderr, "we're back from divideLabour\n" );
246	+
247		// set up the local variables
248
249		int localMol, allMol;
#	Line 649 \| Line 653 \| void SimSetup::makeAtoms( void ){
653		for( i=0; i<mpiSim->getMyNlocal(); i++ ) the_atoms[i]->setGlobalIndex( globalIndex[i] );
654
655		delete[] globalIndex;
656	<	#endif IS_MPI
656	>
657	>	mpiSim->mpiRefresh();
658	>	#endif //IS_MPI
659
660		the_ff->initializeAtoms();
661		}
#	Line 690 \| Line 696 \| void SimSetup::makeBonds( void ){
696
697		#ifdef IS_MPI
698		}
699	<	#endif is_mpi
699	>	#endif //is_mpi
700
701		molIndex++;
702		}

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