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#define __C |
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#include "fSimulation.h" |
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#include <fortranWrappers.hpp> |
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extern "C" { |
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void wrapforcefield_( void (*wrapFunction)( void (*p1) makeAtypeList, |
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void (*p2) initFortranFFList, |
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void (*p3) doForceLoopList, |
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void (*p4) set_sticky_params_List, |
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void (*p5) set_gb_pair_params_List, |
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void (*p6) newEAMtype_List) |
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); |
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void wrapsimmod_ ( void (*wrapFunction)( void (*p1) setFortranSimList, |
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void (*p2) setFortranBoxList, |
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void (*p3) notifyFortranCutOffList) ); |
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#ifdef IS_MPI |
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void wrapsimparallelmod_( void (*wrapFunction)(void (*p1) setFortranMPIlist ) ); |
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#endif // is_mpi |
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} |
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void wrapFF( void (*p1) makeAtypeList, void (*p2) initFortranFFList, |
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void (*p3) doForceLoopList, void (*p4) set_sticky_params_List, |
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void (*p5) set_gb_pair_params_List, void (*p6) newEAMtype_List); |
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void (*makeAtype) makeAtypeList; |
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void (*initFortranFF) initFortranFFList; |
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void (*set_sticky_params) set_sticky_params_List; |
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void (*set_gb_pair_params) set_gb_pair_params_List; |
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void (*newEAMtype) newEAMtype_List; |
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void wrapSimInfo( void (*p1) setFortranSimList, void (*p2) setFortranBoxList, |
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void (*p3) notifyFortranCutOffList ); |
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#ifdef IS_MPI |
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void wrapSimParallel(void (*p1) setFortranMPIlist ); |
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#endif // is_mpi |
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// take care of the ForceField functions |
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ForceFields* currentFF; |
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void wrapMeFF( ForceFields* thisFF ){ |
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currentFF = thisFF; |
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wrapforcefield_( wrapFF ); |
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} |
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void wrapFF( void (*p1) makeAtypeList, void (*p2) initFortranFFList, |
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void (*p3) doForceLoopList, void (*p4) set_sticky_params_List, |
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void (*p5) set_gb_pair_params_List, void (*p6) newEAMtype_List){ |
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makeAtype = p1; |
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initFortranFF = p2; |
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currentFF->setFortranForceLoop( p3 ); |
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set_sticky_params = p4; |
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set_gb_pair_params = p5; |
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newEAMtype = p6; |
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} |
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// wrap the SimInfo functions |
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SimInfo* currentPlug; |
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void wrapMeSimInfo( SimInfo* thePlug ){ |
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currentPlug = thePlug; |
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wrapsimmod_( wrapSimInfo ); |
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} |
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void wrapSimInfo( void (*p1) setFortranSimList, void (*p2) setFortranBoxList, |
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void (*p3) notifyFortranCutOffList){ |
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currentPlug->setInternal( p1, p2, p3 ); |
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} |
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#ifdef IS_MPI |
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// wrap the mpiSim functions |
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mpiSimulation* currentMPIsim; |
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void wrapMeSimParallel( mpiSimulation* thisMPIsim ){ |
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currentMPIsim = thisMPIsim; |
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wrapsimparallelmod_( wrapSimParallel ); |
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} |
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void wrapSimParallel(void (*p1) setFortranMPIlist ){ |
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currentMPIsim->setInternal( p1 ); |
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} |
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#endif // is_mpi |
