| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | mm_mapping_library.F | 47 SUBROUTINE create_ff_map(ff_type) argument
48 CHARACTER(LEN=*), INTENT(IN) :: ff_type local
137 SUBROUTINE destroy_ff_map(ff_type) argument
138 CHARACTER(LEN=*), INTENT(IN) :: ff_type local
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| H A D | force_fields_ext.F | 66 SUBROUTINE read_force_field_gromos(ff_type, para_env, mm_section) argument
68 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
314 SUBROUTINE read_force_field_charmm(ff_type, para_env, mm_section) argument
316 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
682 SUBROUTINE read_force_field_amber(ff_type, para_env, mm_section, particle_set) argument
684 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
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| H A D | force_fields.F | 109 TYPE(force_field_type) :: ff_type local
210 SUBROUTINE print_pot_parameter_file(ff_type, mm_section) argument
212 TYPE(force_field_type) :: ff_type local
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| H A D | force_field_types.F | 185 INTEGER :: ff_type component
223 SUBROUTINE init_ff_type(ff_type) argument
224 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
440 SUBROUTINE deallocate_ff_type(ff_type) argument
441 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
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| H A D | force_fields_all.F | 125 molecule_kind_set, molecule_set, ff_type) argument
130 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
227 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
431 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
550 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
671 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
2557 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
2847 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
3166 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
3216 SUBROUTINE force_field_pack_eicut(atomic_kind_set, ff_type, & argument
[all …]
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| H A D | force_fields_util.F | 106 … molecule_set, ewald_env, fist_nonbond_env, ff_type, root_section, qmmm, & argument
116 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
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| H A D | force_fields_input.F | 88 SUBROUTINE read_force_field_section1(ff_section, mm_section, ff_type, para_env) argument
90 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
1939 SUBROUTINE read_force_field_section(ff_type, para_env, mm_section) argument
1940 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
|
| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | mm_mapping_library.F | 47 SUBROUTINE create_ff_map(ff_type) argument
48 CHARACTER(LEN=*), INTENT(IN) :: ff_type local
137 SUBROUTINE destroy_ff_map(ff_type) argument
138 CHARACTER(LEN=*), INTENT(IN) :: ff_type local
|
| H A D | force_fields_ext.F | 66 SUBROUTINE read_force_field_gromos(ff_type, para_env, mm_section) argument
68 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
314 SUBROUTINE read_force_field_charmm(ff_type, para_env, mm_section) argument
316 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
682 SUBROUTINE read_force_field_amber(ff_type, para_env, mm_section, particle_set) argument
684 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
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| H A D | force_fields.F | 109 TYPE(force_field_type) :: ff_type local
210 SUBROUTINE print_pot_parameter_file(ff_type, mm_section) argument
212 TYPE(force_field_type) :: ff_type local
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| H A D | force_field_types.F | 185 INTEGER :: ff_type component
223 SUBROUTINE init_ff_type(ff_type) argument
224 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
440 SUBROUTINE deallocate_ff_type(ff_type) argument
441 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
|
| H A D | force_fields_all.F | 125 molecule_kind_set, molecule_set, ff_type) argument
130 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
227 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
431 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
550 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
671 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
2557 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
2847 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
3166 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
3216 SUBROUTINE force_field_pack_eicut(atomic_kind_set, ff_type, & argument
[all …]
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| H A D | force_fields_util.F | 106 … molecule_set, ewald_env, fist_nonbond_env, ff_type, root_section, qmmm, & argument
116 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
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| H A D | force_fields_input.F | 88 SUBROUTINE read_force_field_section1(ff_section, mm_section, ff_type, para_env) argument
90 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
1939 SUBROUTINE read_force_field_section(ff_type, para_env, mm_section) argument
1940 TYPE(force_field_type), INTENT(INOUT) :: ff_type local
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| /dports/science/mdynamix/md528/cifo/src/ |
| H A D | Atom.h | 34 string ff_type; //Force Field Type variable
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| H A D | ForceField.cpp | 146 string ff_type(""); in loadFromFile() local
|
| /dports/cad/yosys/yosys-yosys-0.12/passes/techmap/ |
| H A D | dfflegalize.cc | 959 int ff_type = get_ff_type(ff); in legalize_finish() local
1043 enum FfType ff_type; in execute() local
|
| /dports/devel/git-svn/git-2.34.1/builtin/ |
| H A D | merge.c | 102 enum ff_type { enum
|
| /dports/devel/git-p4/git-2.34.1/builtin/ |
| H A D | merge.c | 102 enum ff_type { enum
|
| /dports/devel/git/git-2.34.1/builtin/ |
| H A D | merge.c | 102 enum ff_type { enum
|
| /dports/devel/git-gui/git-2.34.1/builtin/ |
| H A D | merge.c | 102 enum ff_type { enum
|
| /dports/devel/git-cvs/git-2.34.1/builtin/ |
| H A D | merge.c | 102 enum ff_type { enum
|
| /dports/devel/cgit/cgit-1.2.3/git/builtin/ |
| H A D | merge.c | 96 enum ff_type { enum
|
| /dports/astro/gpsbabel/gpsbabel-gpsbabel_1_7_0/ |
| H A D | defs.h | 1001 enum ff_type { enum
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| /dports/devel/swig/swig-4.0.2/Source/Modules/ |
| H A D | allegrocl.cxx | 2700 String *ff_type = compose_foreign_type(n, typedef_type); in typedefHandler() local
|