--- trunk/mdtools/headers/mpiSimulation.hpp	2002/09/30 19:36:00	121
+++ trunk/mdtools/headers/mpiSimulation.hpp	2003/01/24 21:25:04	244
@@ -1,27 +1,62 @@
+#ifndef __MPISIMULATION__
+#define __MPISIMULATION__
 
+#include "SimInfo.hpp"
+#include "MakeStamps.hpp"
+#define __C
+#include "mpiComponentPlan.h"
 
+
 class mpiSimulation{
 public:
 
-    mpiSimulation();
-    ~mpiSimulation();
+  mpiSimulation(SimInfo* the_entryPlug);
+  ~mpiSimulation();
+  
+  void divideLabor( void );
+  
+  int  getMyNode(void)           { return mpiPlug->myNode; }
+  int  getNumberProcessors(void) { return mpiPlug->numberProcessors; }
+  int  getMyMolStart( void )     { return mpiPlug->myMolStart; }
+  int  getMyMolEnd( void )       { return mpiPlug->myMolEnd; }
+  int  getMyMol( void )          { return mpiPlug->myMol; }
+  int  getMyAtomStart( void )    { return mpiPlug->myAtomStart; }
+  int  getMyAtomEnd( void )      { return mpiPlug->myAtomEnd; }
+  int  getMyNlocal( void )       { return mpiPlug->myNlocal; }
+  int  getTotAtoms( void )       { return mpiPlug->nAtomsGlobal; }
+  
 
-    int  getMyNode(void) {return myNode;}
-    int  mpiInitSimulation();
-    int  mpiDistSimulation();
+  // sets the internal function pointer to fortran.
 
+  void setInternal( void (*fSetup)( mpiSimData*, int*, int*, int*) ){
+    setFsimParallel = fSetup;
+  }
+
 private:
 
 protected:
-    int myMolStart;
-    int myMolEnd;
-    int myMol;
-    int  numberProcessors;
-    int  myNode;
-    int  processorNameLen;
-    char processorName[MPI_MAX_PROCESSOR_NAME];
-    int  natomsRow,natomsCol,natomsStart,natomsEnd;
-    int  numberCols,numberRows;
-    int  nmolsRow,nmolsCol,nmolsLocal;
+  SimInfo* entryPlug;
+  mpiSimData* mpiPlug;
 
+  // function to wrap the fortran function
+  void wrapMe();
+  
+  // private function to initialize the fortran side of the simulation
+  void (*setFsimParallel)(mpiSimData* the_mpiPlug, int *nLocal,
+			  int* globalIndex, int* isError );
+
+  // int *myIdents; // is needed by Cpp only. It tells the molecule which stamp it is.
+
 };
+
+
+/**
+   The following pointer is the global declaration of the mpiSim
+   object created when the mpiSimulation creation routine is
+   called. Every one who includes the header file will then have
+   access to all of the routines in mnpiSimulation class. 
+*/ 
+
+extern mpiSimulation* mpiSim;
+
+#endif