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root/group/trunk/OOPSE/libmdtools/Integrator.cpp
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Comparing trunk/OOPSE/libmdtools/Integrator.cpp (file contents):
Revision 558 by mmeineke, Thu Jun 19 19:21:23 2003 UTC vs.
Revision 559 by mmeineke, Thu Jun 19 22:02:44 2003 UTC

# Line 49 | Line 49 | k
49      delete[] moving;
50      delete[] moved;
51      delete[] prePos;
52 k
52    }
53    
54   }
# Line 215 | Line 214 | void Integrator::integrate( void ){
214    currStatus  = statusTime;
215    currTime    = 0.0;;
216  
217 +
218 +  readyCheck();
219 +
220 + #ifdef IS_MPI
221 +  strcpy( checkPointMsg,
222 +          "The integrator is ready to go." );
223 +  MPIcheckPoint();
224 + #endif // is_mpi
225 +
226    while( currTime < runTime ){
227  
228      if( (currTime+dt) >= currStatus ){
# Line 244 | Line 252 | void Integrator::integrate( void ){
252        calcStress = 0;
253        currStatus += statusTime;
254      }
255 +
256 + #ifdef IS_MPI
257 +    strcpy( checkPointMsg,
258 +            "successfully took a time step." );
259 +    MPIcheckPoint();
260 + #endif // is_mpi
261 +
262    }
263  
264    dump_out->writeFinal();

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