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root/group/trunk/OOPSE/libmdtools/fortranWrappers.cpp
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Comparing trunk/OOPSE/libmdtools/fortranWrappers.cpp (file contents):
Revision 462 by gezelter, Sat Apr 5 02:56:27 2003 UTC vs.
Revision 631 by chuckv, Thu Jul 17 19:25:51 2003 UTC

# Line 8 | Line 8 | extern "C" {
8    void wrapforcefield_( void (*wrapFunction)( void (*p1) makeAtypeList,
9                                                void (*p2) initFortranFFList,
10                                                void (*p3) doForceLoopList,
11 <                                              void (*p4) LJ_new_rcut_List,
12 <                                              void (*p5) set_sticky_params_List,
13 <                                              void (*p6) set_gb_pair_params_List )
11 >                                              void (*p4) set_sticky_params_List,
12 >                                              void (*p5) set_gb_pair_params_List,
13 >                                              void (*p6) newEAMtype_List)
14                          );
15    
16    void wrapsimmod_ ( void (*wrapFunction)( void (*p1) setFortranSimList,
17 <                                           void (*p2) setFortranBoxList) );
17 >                                           void (*p2) setFortranBoxList,
18 >                                           void (*p3) notifyFortranCutOffList) );
19  
20   #ifdef IS_MPI
21    void wrapsimparallelmod_( void (*wrapFunction)(void (*p1) setFortranMPIlist ) );
# Line 24 | Line 25 | void wrapFF( void (*p1) makeAtypeList, void (*p2) init
25  
26  
27   void wrapFF( void (*p1) makeAtypeList, void (*p2) initFortranFFList,
28 <             void (*p3) doForceLoopList, void (*p4) LJ_new_rcut_List,
29 <             void (*p5) set_sticky_params_List,
29 <             void (*p6) set_gb_pair_params_List );
28 >             void (*p3) doForceLoopList, void (*p4) set_sticky_params_List,
29 >             void (*p5) set_gb_pair_params_List, void (*p6) newEAMtype_List);
30   void (*makeAtype) makeAtypeList;
31   void (*initFortranFF) initFortranFFList;
32 – void (*LJ_new_rcut) LJ_new_rcut_List;
32   void (*set_sticky_params) set_sticky_params_List;
33   void (*set_gb_pair_params) set_gb_pair_params_List;
34 + void (*newEAMtype) newEAMtype_List;
35  
36 < void wrapSimInfo( void (*p1) setFortranSimList, void (*p2) setFortranBoxList );
36 > void wrapSimInfo( void (*p1) setFortranSimList, void (*p2) setFortranBoxList,
37 >                  void (*p3) notifyFortranCutOffList );
38  
39   #ifdef IS_MPI
40   void wrapSimParallel(void (*p1) setFortranMPIlist );
# Line 51 | Line 52 | void wrapFF( void (*p1) makeAtypeList, void (*p2) init
52    
53  
54   void wrapFF( void (*p1) makeAtypeList, void (*p2) initFortranFFList,
55 <             void (*p3) doForceLoopList, void (*p4) LJ_new_rcut_List,
56 <             void (*p5) set_sticky_params_List,
56 <             void (*p6) set_gb_pair_params_List ){
55 >             void (*p3) doForceLoopList, void (*p4) set_sticky_params_List,
56 >             void (*p5) set_gb_pair_params_List, void (*p6) newEAMtype_List){
57    
58    makeAtype = p1;
59    initFortranFF = p2;
60    currentFF->setFortranForceLoop( p3 );
61 <  LJ_new_rcut = p4;
62 <  set_sticky_params = p5;
63 <  set_gb_pair_params = p6;
61 >  set_sticky_params = p4;
62 >  set_gb_pair_params = p5;
63 >  newEAMtype = p6;
64  
65   }
66  
# Line 74 | Line 74 | void wrapSimInfo( void (*p1) setFortranSimList, void (
74    wrapsimmod_( wrapSimInfo );
75   }
76  
77 < void wrapSimInfo( void (*p1) setFortranSimList, void (*p2) setFortranBoxList ){
77 > void wrapSimInfo( void (*p1) setFortranSimList, void (*p2) setFortranBoxList,
78 >                  void (*p3) notifyFortranCutOffList){
79    
80 <  currentPlug->setInternal( p1, p2 );
80 >  currentPlug->setInternal( p1, p2, p3 );
81   }
82    
83  

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