| 1 | #define __C | 
| 2 | #include "fSimulation.h" | 
| 3 | #include <fortranWrappers.hpp> | 
| 4 |  | 
| 5 |  | 
| 6 | extern "C" { | 
| 7 |  | 
| 8 | void wrapforcefield_( void (*wrapFunction)( void (*p1) makeAtypeList, | 
| 9 | void (*p2) initFortranFFList, | 
| 10 | void (*p3) doForceLoopList, | 
| 11 | void (*p4) set_sticky_params_List, | 
| 12 | void (*p5) set_gb_pair_params_List ) | 
| 13 | ); | 
| 14 |  | 
| 15 | void wrapsimmod_ ( void (*wrapFunction)( void (*p1) setFortranSimList, | 
| 16 | void (*p2) setFortranBoxList, | 
| 17 | void (*p3) notifyFortranCutOffList) ); | 
| 18 |  | 
| 19 | #ifdef IS_MPI | 
| 20 | void wrapsimparallelmod_( void (*wrapFunction)(void (*p1) setFortranMPIlist ) ); | 
| 21 | #endif // is_mpi | 
| 22 |  | 
| 23 | } | 
| 24 |  | 
| 25 |  | 
| 26 | void wrapFF( void (*p1) makeAtypeList, void (*p2) initFortranFFList, | 
| 27 | void (*p3) doForceLoopList, void (*p4) set_sticky_params_List, | 
| 28 | void (*p5) set_gb_pair_params_List ); | 
| 29 | void (*makeAtype) makeAtypeList; | 
| 30 | void (*initFortranFF) initFortranFFList; | 
| 31 | void (*set_sticky_params) set_sticky_params_List; | 
| 32 | void (*set_gb_pair_params) set_gb_pair_params_List; | 
| 33 |  | 
| 34 | void wrapSimInfo( void (*p1) setFortranSimList, void (*p2) setFortranBoxList, | 
| 35 | void (*p3) notifyFortranCutOffList ); | 
| 36 |  | 
| 37 | #ifdef IS_MPI | 
| 38 | void wrapSimParallel(void (*p1) setFortranMPIlist ); | 
| 39 | #endif // is_mpi | 
| 40 |  | 
| 41 |  | 
| 42 | // take care of the ForceField functions | 
| 43 |  | 
| 44 | ForceFields* currentFF; | 
| 45 | void wrapMeFF( ForceFields* thisFF ){ | 
| 46 |  | 
| 47 | currentFF = thisFF; | 
| 48 | wrapforcefield_( wrapFF ); | 
| 49 | } | 
| 50 |  | 
| 51 |  | 
| 52 | void wrapFF( void (*p1) makeAtypeList, void (*p2) initFortranFFList, | 
| 53 | void (*p3) doForceLoopList, void (*p4) set_sticky_params_List, | 
| 54 | void (*p5) set_gb_pair_params_List ){ | 
| 55 |  | 
| 56 | makeAtype = p1; | 
| 57 | initFortranFF = p2; | 
| 58 | currentFF->setFortranForceLoop( p3 ); | 
| 59 | set_sticky_params = p4; | 
| 60 | set_gb_pair_params = p5; | 
| 61 |  | 
| 62 | } | 
| 63 |  | 
| 64 |  | 
| 65 | // wrap the SimInfo functions | 
| 66 |  | 
| 67 | SimInfo* currentPlug; | 
| 68 | void wrapMeSimInfo( SimInfo* thePlug ){ | 
| 69 |  | 
| 70 | currentPlug = thePlug; | 
| 71 | wrapsimmod_( wrapSimInfo ); | 
| 72 | } | 
| 73 |  | 
| 74 | void wrapSimInfo( void (*p1) setFortranSimList, void (*p2) setFortranBoxList, | 
| 75 | void (*p3) notifyFortranCutOffList){ | 
| 76 |  | 
| 77 | currentPlug->setInternal( p1, p2, p3 ); | 
| 78 | } | 
| 79 |  | 
| 80 |  | 
| 81 | #ifdef IS_MPI | 
| 82 |  | 
| 83 | // wrap the mpiSim functions | 
| 84 |  | 
| 85 | mpiSimulation* currentMPIsim; | 
| 86 | void wrapMeSimParallel( mpiSimulation* thisMPIsim ){ | 
| 87 |  | 
| 88 | currentMPIsim = thisMPIsim; | 
| 89 | wrapsimparallelmod_( wrapSimParallel ); | 
| 90 | } | 
| 91 |  | 
| 92 | void wrapSimParallel(void (*p1) setFortranMPIlist ){ | 
| 93 |  | 
| 94 | currentMPIsim->setInternal( p1 ); | 
| 95 | } | 
| 96 |  | 
| 97 |  | 
| 98 | #endif // is_mpi |