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root/OpenMD/trunk/src/restraints/ThermoIntegrationForceManager.cpp
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Comparing trunk/src/restraints/ThermoIntegrationForceManager.cpp (file contents):
Revision 665 by tim, Thu Oct 13 22:26:47 2005 UTC vs.
Revision 990 by chrisfen, Mon Jun 19 01:36:06 2006 UTC

# Line 145 | Line 145 | namespace oopse {
145      tempTau *= factor_;
146      curSnapshot->statData.setTau(tempTau);
147  
148 + //     sprintf(painCave.errMsg, "Before Calc_Restraint_Forces\n");
149 + //     painCave.isFatal = 0;
150 + //     simError();
151 +  
152      // do crystal restraint forces for thermodynamic integration
153      if (simParam->getUseSolidThermInt()) {
154        
# Line 154 | Line 158 | namespace oopse {
158        vHarm_ = restraint_->getVharm();
159        curSnapshot->statData[Stats::VHARM] = vHarm_;
160      }
161 +
162 + //     sprintf(painCave.errMsg, "After Calc_Restraint_Forces\n");
163 + //     painCave.isFatal = 0;
164 + //     simError();
165      
166    }
167    

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