--- trunk/src/brains/SimCreator.cpp 2005/04/13 18:41:17 490 +++ trunk/src/brains/SimCreator.cpp 2005/10/13 22:26:47 665 @@ -71,7 +71,6 @@ namespace oopse { if (worldRank == 0) { #endif // is_mpi - simParams->initalize(); set_interface_stamps(stamps, simParams); #ifdef IS_MPI @@ -96,7 +95,8 @@ namespace oopse { } - SimInfo* SimCreator::createSim(const std::string & mdFileName, bool loadInitCoords) { + SimInfo* SimCreator::createSim(const std::string & mdFileName, + bool loadInitCoords) { MakeStamps * stamps = new MakeStamps(); @@ -106,12 +106,13 @@ namespace oopse { parseFile(mdFileName, stamps, simParams); //create the force field - ForceField * ff = ForceFieldFactory::getInstance()->createForceField( - simParams->getForceField()); + ForceField * ff = ForceFieldFactory::getInstance() + ->createForceField(simParams->getForceField()); if (ff == NULL) { - sprintf(painCave.errMsg, "ForceField Factory can not create %s force field\n", - simParams->getForceField()); + sprintf(painCave.errMsg, + "ForceField Factory can not create %s force field\n", + simParams->getForceField().c_str()); painCave.isFatal = 1; simError(); } @@ -602,7 +603,7 @@ namespace oopse { //invalid initial coordinate file sprintf(painCave.errMsg, "Initial configuration file %s should at least contain one frame\n", - simParams->getInitialConfig()); + simParams->getInitialConfig().c_str()); painCave.isFatal = 1; simError(); }