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// this defines some function lists, that are too long to keep track |
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// of everywhere |
| 6 |
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|
| 7 |
< |
#define makeAtypeList ( int* unique_ident, int* isLJ, int* isSticky, int* isDipole, int* isGB, double* lj_epslon, double* lj_sigma, double* dipole_moment, double* w0, double* v0, double* GB_sigma, double* GB_l2b_ratio, double* GB_eps, double* GB_eps_ratio, double* GB_mu, double* GB_nu, int* status ) |
| 7 |
> |
#define makeAtypeList ( int* unique_ident, int* isLJ, int* isSticky, int* isDipole, int* isGB, double* lj_epslon, double* lj_sigma, double* dipole_moment, int* status ) |
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#define initFortranFFList ( int* LJ_mix_policy, int* useReactionField, int *isError ) |
| 10 |
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| 11 |
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#define doForceLoopList ( double* positionArray, double* RotationMatrixArray, double* unitVectorArray_l, double* forceArray, double *torqueArray, double* StressTensor, double* potentialEnergy, short int* doPotentialCalc, short int* doStressCalc, int* isError ) |
| 12 |
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|
| 13 |
< |
#define setFortranSimList ( simtype* the_Info, int* nLocal, int* identArray, int* nLocalExcludes, int* excludesLocalArray, int* nGloabalsExcludes, int* excludesGlobalArray, int* isError ) |
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> |
#define LJ_new_rcut_List ( double* rcut, int* status ) |
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|
| 15 |
< |
#define setFortranBoxList ( double *BoxArray ) |
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> |
#define set_sticky_params_List ( double* sticky_w0, double* sticky_v0 ) |
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> |
|
| 17 |
> |
#define set_gb_pair_params_List ( double* GB_sigma, double* GB_l2b_ratio, double* GB_eps, double* GB_eps_ratio, double* GB_mu, double* GB_nu ) |
| 18 |
> |
|
| 19 |
> |
#define setFortranSimList ( simtype* the_Info, int* nGlobal, int* nLocal, int* identArray, int* nLocalExcludes, int* excludesLocalArray, int* nGloabalsExcludes, int* excludesGlobalArray, int* molMembershipArray, int* isError ) |
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> |
|
| 21 |
> |
#define setFortranBoxList ( double *Hmat, double *HmatI, int* orthoRhombic ) |
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// BoxArray is a length 3 array |
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| 24 |
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#ifdef IS_MPI |
