--- trunk/OOPSE/libmdtools/mpiSimulation.hpp	2003/10/28 22:25:46	836
+++ trunk/OOPSE/libmdtools/mpiSimulation.hpp	2004/05/27 00:48:12	1198
@@ -14,18 +14,26 @@ class mpiSimulation{ (public)
   mpiSimulation(SimInfo* the_entryPlug);
   ~mpiSimulation();
   
-  int *divideLabor( void );
+  void divideLabor();
   
   int  getMyNode(void)           { return mpiPlug->myNode; }
-  int  getNumberProcessors(void) { return mpiPlug->numberProcessors; }
-  int  getMyNMol( void )         { return mpiPlug->myNMol; }
-  int  getMyNlocal( void )       { return mpiPlug->myNlocal; }
+  int  getNprocessors(void) { return mpiPlug->nProcessors; }
+  int  getLocalNmol( void )         { return mpiPlug->nMolLocal; }
+  int  getLocalNatoms( void )       { return mpiPlug->nAtomsLocal; }
   int  getTotAtoms( void )       { return mpiPlug->nAtomsGlobal; }
   int  getTotNmol( void )        { return mpiPlug->nMolGlobal; }
   int* getAtomToProcMap( void )  { return AtomToProcMap; }
   int* getMolToProcMap( void )   { return MolToProcMap; }
   int* getMolComponentType(void) { return MolComponentType; }
-   
+  vector<int> getGlobalAtomIndex(void) {return globalAtomIndex; }
+  vector<int> getGlobalMolIndex(void) {return globalMolIndex;}
+  int getGlobalToLocalMol(int globalIndex) {return globalToLocalMol[globalIndex];}
+  int getGlobalToLocalAtom(int globalIndex) {return globalToLocalAtom[globalIndex];}
+
+
+  //void globalToLocalMol(int globalIndex, int& whichNode, int& localIndex);
+  //void globalToLocalAtom(int globalIndex, int& whichNode, int& localIndex);
+
   // sets the internal function pointer to fortran.
 
   void setInternal( setFortranMPI_TD fSetup){
@@ -44,7 +52,11 @@ class mpiSimulation{ (public)
   int *MolComponentType;
   int *AtomToProcMap;
   int *AtomType;
+  vector<int> globalAtomIndex;
+  vector<int> globalMolIndex;
 
+  vector<int> globalToLocalMol;
+  vector<int> globalToLocalAtom;
   // private function to initialize the fortran side of the simulation
   setFortranMPI_TD setFsimParallel;