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root/OpenMD/trunk/src/applications/oopse/oopse.cpp
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Comparing trunk/src/applications/oopse/oopse.cpp (file contents):
Revision 691 by chrisfen, Wed Oct 19 19:24:40 2005 UTC vs.
Revision 770 by tim, Fri Dec 2 15:38:03 2005 UTC

# Line 138 | Line 138 | int main(int argc,char* argv[]){
138      //create Integrator
139  
140      Integrator* myIntegrator = IntegratorFactory::getInstance()->createIntegrator(toUpperCopy(simParams->getEnsemble()), info);
141 <
141 >
142      if (myIntegrator == NULL) {
143        sprintf(painCave.errMsg, "Integrator Factory can not create %s Integrator\n",
144                simParams->getEnsemble().c_str());
# Line 152 | Line 152 | int main(int argc,char* argv[]){
152  
153  
154      //Zconstraint-Method
155 <    if (simParams->haveNZconstraints()) {
156 <      info->setNZconstraint(simParams->getNZconstraints());
155 >    if (simParams->getNZconsStamps() > 0) {
156 >      info->setNZconstraint(simParams->getNZconsStamps());
157        ForceManager* fman = new ZconstraintForceManager(info);
158        myIntegrator->setForceManager(fman);
159      }

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