| 1 | 
mmeineke | 
377 | 
#ifdef IS_MPI | 
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#include <stdlib.h> | 
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#include <stdio.h> | 
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#include <string.h> | 
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#define __mpiBASSEVENT | 
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#include "mpiBASS.h" | 
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#include "simError.h" | 
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void mpiCatchEvent(void); | 
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void mpiEventInit(void) | 
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{ | 
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  int blockCounts[5] = {1,3,4,120,80}; | 
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  MPI_Aint dspls[5]; | 
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  MPI_Datatype types[5]; | 
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  mBEvent protoEvent; | 
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  int i;   | 
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  MPI_Address(&protoEvent.type, &dspls[0]); | 
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  MPI_Address(&protoEvent.d1, &dspls[1]); | 
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  MPI_Address(&protoEvent.i1, &dspls[2]); | 
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  MPI_Address(&protoEvent.cArray, &dspls[3]); | 
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  MPI_Address(&protoEvent.lhs   , &dspls[4]); | 
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  types[0] = MPI_INT; | 
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  types[1] = MPI_DOUBLE; | 
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  types[2] = MPI_INT; | 
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  types[3] = MPI_CHAR; | 
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  types[4] = MPI_CHAR; | 
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  for (i =4; i >= 0; i--) dspls[i] -= dspls[0]; | 
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  MPI_Type_struct(5,blockCounts,dspls,types,&mpiBASSEventType); | 
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  MPI_Type_commit(&mpiBASSEventType); | 
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} | 
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void throwMPIEvent(event* the_event) | 
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{ | 
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  mBEvent mpiEventContainer; | 
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  int mpiStatus; | 
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  if (the_event == NULL)     mpiStatus = MPI_INTERFACE_DONE; | 
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  else                       mpiStatus = MPI_INTERFACE_CONTINUE; | 
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   | 
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  MPI_Bcast(&mpiStatus,1,MPI_INT,0,MPI_COMM_WORLD); | 
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   | 
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  if (!mpiStatus){ | 
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    switch (the_event->event_type){ | 
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    case MOLECULE: | 
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      mpiEventContainer.type = mpiMOLECULE; | 
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      mpiEventContainer.i1 = the_event->evt.blk_index; // pack block index into first int   | 
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    break; | 
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gezelter | 
957 | 
    case RIGIDBODY: | 
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      mpiEventContainer.type = mpiRIGIDBODY; | 
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      mpiEventContainer.i1 = the_event->evt.blk_index; // pack block index into first int   | 
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    break; | 
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mmeineke | 
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    case ATOM: | 
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      mpiEventContainer.type = mpiATOM; | 
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      mpiEventContainer.i1 = the_event->evt.blk_index; // pack block index into first int | 
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      break; | 
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    case BOND: | 
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      mpiEventContainer.type = mpiBOND; | 
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      mpiEventContainer.i1 = the_event->evt.blk_index; // pack block index into first int | 
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      break; | 
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    case BEND: | 
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      mpiEventContainer.type = mpiBEND; | 
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      mpiEventContainer.i1 = the_event->evt.blk_index; // pack block index into first int | 
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      break; | 
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    case TORSION: | 
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      mpiEventContainer.type = mpiTORSION; | 
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      mpiEventContainer.i1 = the_event->evt.blk_index; // pack block index into first int | 
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      break; | 
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mmeineke | 
675 | 
    case ZCONSTRAINT: | 
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      mpiEventContainer.type = mpiZCONSTRAINT; | 
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      mpiEventContainer.i1 = the_event->evt.blk_index; // pack block index into first int | 
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      break; | 
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mmeineke | 
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    case COMPONENT: | 
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      mpiEventContainer.type = mpiCOMPONENT; | 
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      mpiEventContainer.i1 = the_event->evt.blk_index; // pack block index into first int | 
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      break; | 
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    case POSITION: | 
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      mpiEventContainer.type = mpiPOSITION; | 
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      mpiEventContainer.d1 = the_event->evt.pos.x; // pack pos coord into d | 
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      mpiEventContainer.d2 = the_event->evt.pos.y;  | 
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      mpiEventContainer.d3 = the_event->evt.pos.z;    | 
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      break; | 
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    case ORIENTATION: | 
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      mpiEventContainer.type = mpiORIENTATION; | 
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      mpiEventContainer.d1 = the_event->evt.ornt.x; // pack orientation coord into d | 
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      mpiEventContainer.d2 = the_event->evt.ornt.y;  | 
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      mpiEventContainer.d3 = the_event->evt.ornt.z;    | 
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      break; | 
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       | 
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    case CONSTRAINT: | 
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      mpiEventContainer.type = mpiCONSTRAINT; | 
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      mpiEventContainer.d1 = the_event->evt.cnstr; // pack constraint coord into d | 
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      break; | 
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       | 
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    case MEMBER: | 
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      mpiEventContainer.type = mpiMEMBER; | 
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      mpiEventContainer.i1 = the_event->evt.mbr.a ; // pack member ints into i | 
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      mpiEventContainer.i2 = the_event->evt.mbr.b;  | 
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      mpiEventContainer.i3 = the_event->evt.mbr.c;    | 
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      mpiEventContainer.i4 = the_event->evt.mbr.d;    | 
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      break; | 
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       | 
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    case ASSIGNMENT: | 
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      strcpy(mpiEventContainer.lhs,the_event->evt.asmt.lhs); | 
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#ifdef MPIBASS_VERBOSE | 
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      fprintf(stderr,  | 
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              "mpiDiag at node %d: evt Assignment: \"%s\" = ?\n" | 
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              "                    mpi Assignment: \"%s\" = ?\n", | 
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              worldRank,  | 
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              the_event->evt.asmt.lhs, | 
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              mpiEventContainer.lhs); | 
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#endif | 
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      switch (the_event->evt.asmt.asmt_type){ | 
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      case STRING: | 
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        mpiEventContainer.type = mpiASSIGNMENT_s; | 
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        strcpy(mpiEventContainer.cArray,the_event->evt.asmt.rhs.sval); | 
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        break; | 
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      case INT: | 
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        mpiEventContainer.type = mpiASSIGNMENT_i; | 
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        mpiEventContainer.i1 = the_event->evt.asmt.rhs.ival; | 
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        break; | 
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      case DOUBLE: | 
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        mpiEventContainer.type = mpiASSIGNMENT_d; | 
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        mpiEventContainer.d1 = the_event->evt.asmt.rhs.dval; | 
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        break; | 
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      } | 
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      break; | 
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    case BLOCK_END: | 
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      mpiEventContainer.type = mpiBLOCK_END; | 
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      break; | 
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    } | 
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    MPI_Bcast(&mpiEventContainer,1,mpiBASSEventType,0,MPI_COMM_WORLD); | 
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    sprintf( checkPointMsg,  | 
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             "BASS Event broadcast successful" ); | 
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    MPIcheckPoint(); | 
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  } | 
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} | 
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// Everybody but node 0 runs this | 
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void mpiEventLoop(void) | 
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{ | 
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  int mpiContinue; | 
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#ifdef MPIBASS_VERBOSE | 
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  fprintf(stderr,  | 
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          "event key List at node %d:\n" | 
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          "  MOLECULE    %d\n" | 
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          "  ATOM        %d\n" | 
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          "  BOND        %d\n" | 
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          "  BEND        %d\n" | 
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          "  TORSION     %d\n" | 
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          "  COMPONENT   %d\n" | 
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          "  POSITION    %d\n" | 
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          "  ASSIGNMENT  %d\n" | 
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          "  MEMBER      %d\n" | 
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          "  CONSTRAINT  %d\n" | 
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          "  ORIENTATION %d\n" | 
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mmeineke | 
675 | 
          "  ZCONSTRAINT %d\n" | 
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gezelter | 
957 | 
          "  RIGIDBODY   %d\n" | 
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mmeineke | 
377 | 
          "  BLOCK_END   %d\n" | 
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          "\n", | 
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          worldRank, | 
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          MOLECULE, ATOM, BOND, BEND, TORSION, COMPONENT,  | 
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          POSITION, ASSIGNMENT, MEMBER, CONSTRAINT, ORIENTATION, | 
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gezelter | 
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          ZCONSTRAINT, RIGIDBODY, BLOCK_END ); | 
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mmeineke | 
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#endif | 
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  MPI_Bcast(&mpiContinue,1,MPI_INT,0,MPI_COMM_WORLD); | 
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  while(!mpiContinue){ | 
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    mpiCatchEvent(); | 
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    MPI_Bcast(&mpiContinue,1,MPI_INT,0,MPI_COMM_WORLD); | 
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  } | 
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  if (mpiContinue == MPI_INTERFACE_ABORT){ | 
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    MPI_Finalize(); | 
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    exit (0); | 
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  } | 
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} | 
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void mpiCatchEvent(void) | 
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{ | 
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  event the_event; | 
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  mBEvent mpiEventContainer; | 
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  MPI_Bcast(&mpiEventContainer,1,mpiBASSEventType,0,MPI_COMM_WORLD); | 
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  switch (mpiEventContainer.type){ | 
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  case mpiMOLECULE: | 
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    the_event.event_type = MOLECULE; | 
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    the_event.evt.blk_index = mpiEventContainer.i1; | 
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    break; | 
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gezelter | 
957 | 
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  case mpiRIGIDBODY: | 
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    the_event.event_type = RIGIDBODY; | 
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    the_event.evt.blk_index = mpiEventContainer.i1; | 
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    break; | 
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mmeineke | 
377 | 
     | 
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  case mpiATOM: | 
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    the_event.event_type = ATOM; | 
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    the_event.evt.blk_index = mpiEventContainer.i1; | 
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    break; | 
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     | 
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  case mpiBOND: | 
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    the_event.event_type = BOND; | 
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    the_event.evt.blk_index = mpiEventContainer.i1; | 
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    break; | 
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       | 
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  case mpiBEND: | 
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    the_event.event_type = BEND; | 
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    the_event.evt.blk_index = mpiEventContainer.i1; | 
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    break; | 
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  case mpiTORSION: | 
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    the_event.event_type = TORSION; | 
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    the_event.evt.blk_index = mpiEventContainer.i1; | 
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    break; | 
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mmeineke | 
675 | 
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  case mpiZCONSTRAINT: | 
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    the_event.event_type = ZCONSTRAINT; | 
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    the_event.evt.blk_index = mpiEventContainer.i1; | 
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    break; | 
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mmeineke | 
377 | 
     | 
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  case mpiCOMPONENT: | 
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    the_event.event_type = COMPONENT; | 
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    the_event.evt.blk_index = mpiEventContainer.i1; | 
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    break; | 
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  case mpiPOSITION: | 
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    the_event.event_type = POSITION; | 
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    the_event.evt.pos.x = mpiEventContainer.d1;  | 
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    the_event.evt.pos.y = mpiEventContainer.d2;  | 
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    the_event.evt.pos.z = mpiEventContainer.d3;    | 
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    break; | 
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  case mpiORIENTATION: | 
| 275 | 
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    the_event.event_type = ORIENTATION; | 
| 276 | 
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    the_event.evt.ornt.x = mpiEventContainer.d1;  | 
| 277 | 
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    the_event.evt.ornt.y = mpiEventContainer.d2;  | 
| 278 | 
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    the_event.evt.ornt.z = mpiEventContainer.d3;    | 
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    break; | 
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       | 
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  case mpiCONSTRAINT: | 
| 282 | 
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    the_event.event_type = CONSTRAINT; | 
| 283 | 
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    the_event.evt.cnstr = mpiEventContainer.d1;  | 
| 284 | 
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    break; | 
| 285 | 
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     | 
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  case mpiMEMBER: | 
| 287 | 
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    the_event.event_type = MEMBER; | 
| 288 | 
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    the_event.evt.mbr.a = mpiEventContainer.i1;  | 
| 289 | 
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    the_event.evt.mbr.b = mpiEventContainer.i2;  | 
| 290 | 
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    the_event.evt.mbr.c = mpiEventContainer.i3;    | 
| 291 | 
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    the_event.evt.mbr.d = mpiEventContainer.i4;    | 
| 292 | 
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    break; | 
| 293 | 
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     | 
| 294 | 
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  case mpiASSIGNMENT_s: | 
| 295 | 
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    the_event.event_type = ASSIGNMENT; | 
| 296 | 
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    the_event.evt.asmt.asmt_type = STRING; | 
| 297 | 
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    strcpy(the_event.evt.asmt.lhs,mpiEventContainer.lhs); | 
| 298 | 
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    strcpy(the_event.evt.asmt.rhs.sval,mpiEventContainer.cArray); | 
| 299 | 
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     | 
| 300 | 
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#ifdef MPIBASS_VERBOSE | 
| 301 | 
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 | 
| 302 | 
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    fprintf(stderr, "mpiDiag at node %d: Assignment:  %s = %s\n", worldRank,  | 
| 303 | 
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            the_event.evt.asmt.lhs, | 
| 304 | 
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            the_event.evt.asmt.rhs.sval ); | 
| 305 | 
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#endif | 
| 306 | 
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 | 
| 307 | 
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    break; | 
| 308 | 
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 | 
| 309 | 
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  case mpiASSIGNMENT_i: | 
| 310 | 
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    the_event.event_type = ASSIGNMENT; | 
| 311 | 
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    the_event.evt.asmt.asmt_type = INT; | 
| 312 | 
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    strcpy(the_event.evt.asmt.lhs,mpiEventContainer.lhs); | 
| 313 | 
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    the_event.evt.asmt.rhs.ival = mpiEventContainer.i1;       | 
| 314 | 
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 | 
| 315 | 
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#ifdef MPIBASS_VERBOSE | 
| 316 | 
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 | 
| 317 | 
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    fprintf(stderr, "mpiDiag at node %d: Assignment:  %s = %d\n", worldRank,  | 
| 318 | 
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            the_event.evt.asmt.lhs, | 
| 319 | 
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            the_event.evt.asmt.rhs.ival ); | 
| 320 | 
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#endif | 
| 321 | 
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 | 
| 322 | 
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  | 
    break; | 
| 323 | 
  | 
  | 
 | 
| 324 | 
  | 
  | 
  case mpiASSIGNMENT_d: | 
| 325 | 
  | 
  | 
    the_event.event_type = ASSIGNMENT; | 
| 326 | 
  | 
  | 
    the_event.evt.asmt.asmt_type = DOUBLE; | 
| 327 | 
  | 
  | 
    strcpy(the_event.evt.asmt.lhs,mpiEventContainer.lhs); | 
| 328 | 
  | 
  | 
    the_event.evt.asmt.rhs.dval = mpiEventContainer.d1;       | 
| 329 | 
  | 
  | 
 | 
| 330 | 
  | 
  | 
#ifdef MPIBASS_VERBOSE | 
| 331 | 
  | 
  | 
 | 
| 332 | 
  | 
  | 
    fprintf(stderr, "mpiDiag at node %d: Assignment:  %s = %lf\n", worldRank,  | 
| 333 | 
  | 
  | 
            the_event.evt.asmt.lhs, | 
| 334 | 
  | 
  | 
            the_event.evt.asmt.rhs.dval ); | 
| 335 | 
  | 
  | 
#endif | 
| 336 | 
  | 
  | 
 | 
| 337 | 
  | 
  | 
    break; | 
| 338 | 
  | 
  | 
 | 
| 339 | 
  | 
  | 
  case mpiBLOCK_END: | 
| 340 | 
  | 
  | 
    the_event.event_type = BLOCK_END; | 
| 341 | 
  | 
  | 
    break; | 
| 342 | 
  | 
  | 
  } | 
| 343 | 
  | 
  | 
 | 
| 344 | 
  | 
  | 
#ifdef MPIBASS_VERBOSE | 
| 345 | 
  | 
  | 
 | 
| 346 | 
  | 
  | 
  fprintf(stderr, "mpiDiag at node %d: event type is %d\n", worldRank,  | 
| 347 | 
  | 
  | 
          the_event.event_type); | 
| 348 | 
  | 
  | 
#endif | 
| 349 | 
  | 
  | 
 | 
| 350 | 
  | 
  | 
  if (!event_handler(&the_event)){  | 
| 351 | 
  | 
  | 
 | 
| 352 | 
  | 
  | 
    sprintf(painCave.errMsg, | 
| 353 | 
  | 
  | 
            "MPI event handling error at node %d => %s\n", | 
| 354 | 
  | 
  | 
            worldRank, | 
| 355 | 
  | 
  | 
            the_event.err_msg); | 
| 356 | 
  | 
  | 
    painCave.isFatal = 1; | 
| 357 | 
  | 
  | 
    simError(); | 
| 358 | 
  | 
  | 
  } | 
| 359 | 
  | 
  | 
  MPIcheckPoint(); | 
| 360 | 
  | 
  | 
} | 
| 361 | 
  | 
  | 
 | 
| 362 | 
  | 
  | 
 | 
| 363 | 
  | 
  | 
void mpiInterfaceExit(void){ | 
| 364 | 
  | 
  | 
  int mpiStatus = MPI_INTERFACE_ABORT; | 
| 365 | 
  | 
  | 
   | 
| 366 | 
  | 
  | 
  MPI_Bcast(&mpiStatus,1,MPI_INT,0,MPI_COMM_WORLD); | 
| 367 | 
  | 
  | 
  MPI_Finalize(); | 
| 368 | 
  | 
  | 
  exit (0); | 
| 369 | 
  | 
  | 
 | 
| 370 | 
  | 
  | 
} | 
| 371 | 
  | 
  | 
#endif |