--- trunk/OOPSE/libmdtools/SimSetup.hpp	2003/04/14 21:22:54	498
+++ trunk/OOPSE/libmdtools/SimSetup.hpp	2003/07/15 17:57:04	614
@@ -27,16 +27,38 @@ class SimSetup{ (private)
   void receiveParse(void);
 #endif
 
-  void makeMolecules( void );
+  void gatherInfo( void );
+  void sysObjectsCreation( void );
+  void finalInfoCheck( void );
+  void initSystemCoords( void );
+  void makeOutNames(void);
 
+  void createFF( void );
+  void compList( void );
+  void calcSysValues( void );
+  void makeSysArrays( void );
+
+#ifdef IS_MPI
+  void mpiMolDivide( void );
+
+  int* mol2proc;
+  int* molCompType;
+
+#endif //is_mpi
+
   void initFromBass( void );
+  void makeMolecules( void );
   void makeElement( double x, double y, double z );
 
+  int ensembleCase;
+  int ffCase;
+
+
   MakeStamps* stamps;
   Globals* globals;
   char* inFileName;
 
-  SimInfo* simnfo;
+  SimInfo* info;
 
   int n_components;