Searched refs:engine_bp (Results 1 – 11 of 11) sorted by relevance
/dports/science/libghemical/libghemical-3.0.0/src/ |
H A D | engine.h | 32 class engine_bp; // boundary potential variable 323 class engine_bp : virtual public engine 341 engine_bp(setup *, i32u); 342 virtual ~engine_bp(void); 383 engine_bp * eng; 395 number_density_evaluator(engine_bp *, bool, i32s); 433 engine_bp * eng; 453 radial_density_function_evaluator(engine_bp *, i32s, f64, f64, f64 = -1.0, f64 = -1.0);
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H A D | engine.cpp | 763 engine_bp::engine_bp(setup * p1, i32u p2) : engine(p1, p2) in engine_bp() function in engine_bp 773 engine_bp::~engine_bp(void) in ~engine_bp() 880 number_density_evaluator::number_density_evaluator(engine_bp * p1, bool p2, i32s p3) in number_density_evaluator() 971 radial_density_function_evaluator::radial_density_function_evaluator(engine_bp * p1, i32s p2, f64 g… in radial_density_function_evaluator()
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H A D | eng2_qm_mm.cpp | 200 engine_bp(p1, p2), in eng2_qm_mm_mopac() 326 engine_bp(p1, p2), in eng2_qm_mm_mpqc()
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H A D | eng1_mm_tripos52.h | 181 class eng1_mm_tripos52_nbt_bp : virtual public eng1_mm, virtual public engine_bp
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H A D | eng1_mm_default.h | 203 class eng1_mm_default_nbt_bp : virtual public eng1_mm, virtual public engine_bp
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H A D | model.h | 167 friend class engine_bp; variable
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H A D | eng1_sf.h | 658 class eng1_sf : virtual public engine_bp
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H A D | model.cpp | 2663 engine_bp * eng_bp = dynamic_cast<engine_bp *>(eng); in DoGeomOpt() 2848 engine_bp * eng_bp = dynamic_cast<engine_bp *>(eng); in DoMolDyn() 4327 engine_bp * eng_bp = dynamic_cast<engine_bp *>(dyn->eng); in WriteTrajectoryFrame()
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H A D | eng1_mm_tripos52.cpp | 831 engine_bp(p1, p2) in eng1_mm_tripos52_nbt_bp() 1376 engine_bp(p1, p2), in eng1_mm_tripos52_bp()
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H A D | eng1_mm_default.cpp | 1110 engine_bp(p1, p2) in eng1_mm_default_nbt_bp() 1763 engine_bp(p1, p2), in eng1_mm_default_bp()
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H A D | eng1_sf.cpp | 1057 engine_bp(p1, p2) in eng1_sf()
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