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Searched refs:MGparm (Results 1 – 25 of 35) sorted by relevance

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/dports/science/apbs/apbs-pdb2pqr-apbs-1.5-102-g500c1473/apbs/src/generic/
H A Dmgparm.h203 typedef struct sMGparm MGparm; typedef
211 VEXTERNC int MGparm_getNx(MGparm *thee);
219 VEXTERNC int MGparm_getNy(MGparm *thee);
227 VEXTERNC int MGparm_getNz(MGparm *thee);
235 VEXTERNC double MGparm_getHx(MGparm *thee);
243 VEXTERNC double MGparm_getHy(MGparm *thee);
251 VEXTERNC double MGparm_getHz(MGparm *thee);
283 VEXTERNC double MGparm_getCenterX(MGparm *thee);
323 VEXTERNC void MGparm_dtor(MGparm **thee);
330 VEXTERNC void MGparm_dtor2(MGparm *thee);
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H A Dmgparm.c89 VPUBLIC int MGparm_getNx(MGparm *thee) { in MGparm_getNx()
93 VPUBLIC int MGparm_getNy(MGparm *thee) { in MGparm_getNy()
97 VPUBLIC int MGparm_getNz(MGparm *thee) { in MGparm_getNz()
101 VPUBLIC double MGparm_getHx(MGparm *thee) { in MGparm_getHx()
105 VPUBLIC double MGparm_getHy(MGparm *thee) { in MGparm_getHy()
109 VPUBLIC double MGparm_getHz(MGparm *thee) { in MGparm_getHz()
117 MGparm *thee = VNULL; in MGparm_ctor()
118 thee = (MGparm*)Vmem_malloc(VNULL, 1, sizeof(MGparm)); in MGparm_ctor()
175 VPUBLIC void MGparm_dtor(MGparm **thee) { in MGparm_dtor()
183 VPUBLIC void MGparm_dtor2(MGparm *thee) { ; } in MGparm_dtor2()
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H A Dnosh.h173 MGparm *mgparm; /**< Multigrid parameters */
/dports/science/tinker/tinker/apbs/include/linux/apbs/
H A Dmgparm.h192 typedef struct sMGparm MGparm; typedef
200 VEXTERNC int MGparm_getNx(MGparm *thee);
208 VEXTERNC int MGparm_getNy(MGparm *thee);
216 VEXTERNC int MGparm_getNz(MGparm *thee);
224 VEXTERNC double MGparm_getHx(MGparm *thee);
232 VEXTERNC double MGparm_getHy(MGparm *thee);
240 VEXTERNC double MGparm_getHz(MGparm *thee);
272 VEXTERNC double MGparm_getCenterX(MGparm *thee);
312 VEXTERNC void MGparm_dtor(MGparm **thee);
319 VEXTERNC void MGparm_dtor2(MGparm *thee);
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H A Dvpmgp.h214 VEXTERNC Vpmgp* Vpmgp_ctor(MGparm *mgparm);
224 VEXTERNC int Vpmgp_ctor2(Vpmgp *thee, MGparm *mgparm);
H A Droutines.h206 VEXTERNC void printMGPARM(MGparm *mgparm, double realCenter[3]);
216 MGparm *mgparm, /**< Object with MG-specific parameters */
261 VEXTERNC int setPartMG(NOsh *nosh, MGparm *mgparm, Vpmg *pmg);
299 VEXTERNC int forceMG(Vmem *mem, NOsh *nosh, PBEparm *pbeparm, MGparm *mgparm,
H A Dvpmg.h198 MGparm *mgparm, /**< MGparm parameter object for boundary conditions */
216 MGparm *mgparm, /**< MGparm parameter object for boundary
H A Dnosh.h156 MGparm *mgparm; /**< Multigrid parameters */
/dports/science/tinker/tinker/apbs/include/macos/apbs/
H A Dmgparm.h192 typedef struct sMGparm MGparm; typedef
200 VEXTERNC int MGparm_getNx(MGparm *thee);
208 VEXTERNC int MGparm_getNy(MGparm *thee);
216 VEXTERNC int MGparm_getNz(MGparm *thee);
224 VEXTERNC double MGparm_getHx(MGparm *thee);
232 VEXTERNC double MGparm_getHy(MGparm *thee);
240 VEXTERNC double MGparm_getHz(MGparm *thee);
272 VEXTERNC double MGparm_getCenterX(MGparm *thee);
312 VEXTERNC void MGparm_dtor(MGparm **thee);
319 VEXTERNC void MGparm_dtor2(MGparm *thee);
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H A Dvpmgp.h214 VEXTERNC Vpmgp* Vpmgp_ctor(MGparm *mgparm);
224 VEXTERNC int Vpmgp_ctor2(Vpmgp *thee, MGparm *mgparm);
H A Droutines.h206 VEXTERNC void printMGPARM(MGparm *mgparm, double realCenter[3]);
216 MGparm *mgparm, /**< Object with MG-specific parameters */
261 VEXTERNC int setPartMG(NOsh *nosh, MGparm *mgparm, Vpmg *pmg);
299 VEXTERNC int forceMG(Vmem *mem, NOsh *nosh, PBEparm *pbeparm, MGparm *mgparm,
H A Dvpmg.h198 MGparm *mgparm, /**< MGparm parameter object for boundary conditions */
216 MGparm *mgparm, /**< MGparm parameter object for boundary
H A Dnosh.h156 MGparm *mgparm; /**< Multigrid parameters */
/dports/science/apbs/apbs-pdb2pqr-apbs-1.5-102-g500c1473/apbs/tools/python/
H A Dapbslib.i56 MGparm();
57 ~MGparm();
59 } MGparm; typedef
60 extern void MGparm_setCenterX(MGparm *thee, double x);
61 extern void MGparm_setCenterY(MGparm *thee, double y);
62 extern void MGparm_setCenterZ(MGparm *thee, double z);
112 MGparm *mgparm;
349 int wrap_forceMG(Vmem *mem, NOsh *nosh, PBEparm *pbeparm, MGparm *mgparm, in wrap_forceMG()
478 extern void printMGPARM(MGparm *mgparm, double realCenter[3]);
479 extern int initMG(int i, NOsh *nosh, MGparm *mgparm,
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H A Dapbslib_wrap.doc9 1. class MGparm
11 [ created from struct MGparm ]
14 MGparm()
15 [ Constructor: returns MGparm * ]
112 [ Member data: returns MGparm * ]
H A Dapbslib.c3409 result = (MGparm *)(MGparm *) calloc(1, sizeof(MGparm)); in _wrap_new_MGparm()
3419 MGparm *arg1 = (MGparm *) 0 ; in _wrap_delete_MGparm()
3441 MGparm *arg1 = (MGparm *) 0 ; in _wrap_MGparm_type_set()
3472 MGparm *arg1 = (MGparm *) 0 ; in _wrap_MGparm_type_get()
3501 MGparm *arg1 = (MGparm *) 0 ; in _wrap_MGparm_setCenterX()
3531 MGparm *arg1 = (MGparm *) 0 ; in _wrap_MGparm_setCenterY()
3561 MGparm *arg1 = (MGparm *) 0 ; in _wrap_MGparm_setCenterZ()
4193 MGparm *arg2 = (MGparm *) 0 ; in _wrap_NOsh_calc_mgparm_set()
5743 MGparm *arg4 = (MGparm *) 0 ; in _wrap_wrap_forceMG()
6338 MGparm *arg1 = (MGparm *) 0 ; in _wrap_printMGPARM()
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/dports/science/apbs/apbs-pdb2pqr-apbs-1.5-102-g500c1473/apbs/src/mg/
H A Dvpmgp.h224 VEXTERNC Vpmgp* Vpmgp_ctor(MGparm *mgparm);
234 VEXTERNC int Vpmgp_ctor2(Vpmgp *thee, MGparm *mgparm);
H A Dvpmgp.c76 VPUBLIC Vpmgp* Vpmgp_ctor(MGparm *mgparm) { in Vpmgp_ctor()
93 VPUBLIC int Vpmgp_ctor2(Vpmgp *thee,MGparm *mgparm) { in Vpmgp_ctor2()
H A Dvpmg.h231 MGparm *mgparm, /**< MGparm parameter object for boundary conditions */
249 MGparm *mgparm, /**< MGparm parameter object for boundary
/dports/science/apbs/apbs-pdb2pqr-apbs-1.5-102-g500c1473/apbs/src/
H A Droutines.h234 VEXTERNC void printMGPARM(MGparm *mgparm, double realCenter[3]);
244 MGparm *mgparm, /**< Object with MG-specific parameters */
289 VEXTERNC int setPartMG(NOsh *nosh, MGparm *mgparm, Vpmg *pmg);
327 VEXTERNC int forceMG(Vmem *mem, NOsh *nosh, PBEparm *pbeparm, MGparm *mgparm,
712 VEXTERNC void printMGPARM(MGparm *mgparm, double realCenter[3]);
/dports/science/tinker/tinker/apbs/test/
H A Dio.mc86 MGparm_check: checking MGparm object of type 0.
125 MGparm_check: checking MGparm object of type 0.
134 MGparm_check: checking MGparm object of type 0.
212 MGparm_check: checking MGparm object of type 0.
306 MGparm_check: checking MGparm object of type 0.
384 MGparm_check: checking MGparm object of type 0.
484 MGparm_check: checking MGparm object of type 0.
562 MGparm_check: checking MGparm object of type 0.
659 MGparm_check: checking MGparm object of type 0.
737 MGparm_check: checking MGparm object of type 0.
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/dports/science/apbs/apbs-pdb2pqr-apbs-1.5-102-g500c1473/apbs/contrib/iapbs/src/
H A Dapbs_driver.h211 MGparm *mgparm,
/dports/science/apbs/apbs-pdb2pqr-apbs-1.5-102-g500c1473/doc/releases/
H A D200402-APBS-0.3.0.rst78 * Moved chgm from PBEparm to MGparm
82 * Changed many NOsh, FEMparm, MGparm variables to enums
H A D200707-APBS-0.5.1.rst14 * Added warning about strange grid settings (MGparm)
/dports/science/apbs/apbs-pdb2pqr-apbs-1.5-102-g500c1473/pdb2pqr/pdb2pka/
H A Dexample.py75 mgparm = MGparm()

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