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root/OpenMD/trunk/src/integrators/Integrator.cpp
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Comparing trunk/src/integrators/Integrator.cpp (file contents):
Revision 276 by tim, Wed Jan 26 15:26:47 2005 UTC vs.
Revision 326 by tim, Sun Feb 13 20:05:42 2005 UTC

# Line 45 | Line 45 | Integrator::Integrator(SimInfo* info)
45   namespace oopse {
46   Integrator::Integrator(SimInfo* info)
47      : info_(info), forceMan_(NULL) , needPotential(false), needStress(false), velocitizer_(NULL),
48 <      needVelocityScaling(false), dumpWriter(NULL), eorWriter(NULL), statWriter(NULL), thermo(info),
48 >      needVelocityScaling(false), dumpWriter(NULL), statWriter(NULL), thermo(info),
49        currentSnapshot_(info->getSnapshotManager()->getCurrentSnapshot()) {
50  
51      Globals* simParams = info->getSimParams();
# Line 62 | Line 62 | Integrator::Integrator(SimInfo* info)
62      if (simParams->haveRunTime()) {
63          runTime = simParams->getRunTime();
64      } else {
65 <
65 >            sprintf(painCave.errMsg,
66 >                    "Integrator Error: runTime is not set\n");
67 >            painCave.isFatal = 1;
68 >            simError();
69      }
70      // set the status, sample, and thermal kick times
71      if (simParams->haveSampleTime()){
# Line 118 | Line 121 | Integrator::~Integrator(){
121      delete velocitizer_;
122      
123      delete dumpWriter;
121 –    delete eorWriter;
124      delete statWriter;
125   }
126  

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