Searched refs:PROG_IS_MOLPRO (Results 1 – 10 of 10) sorted by relevance
182 else if(!strcmp(name,"InsertMolproGeneral")) {iprogram = PROG_IS_MOLPRO; insert_molpro(1); } in activate_action()183 else if(!strcmp(name,"InsertMolproGeometry")) {iprogram = PROG_IS_MOLPRO; insert_molpro(2); } in activate_action()184 else if(!strcmp(name,"InsertMolproBasis")) { iprogram = PROG_IS_MOLPRO; insert_molpro(3);} in activate_action()185 else if(!strcmp(name,"InsertMolproCommands")) { iprogram = PROG_IS_MOLPRO; insert_molpro(4);} in activate_action()186 else if(!strcmp(name,"GeometryMolpro")) {iprogram = PROG_IS_MOLPRO; insert_molpro(2); } in activate_action()
37 #define PROG_IS_MOLPRO GABEDIT_TYPENODE_MOLPRO macro
271 iprogram = PROG_IS_MOLPRO; in set_default_entrys()646 if(iprogram == PROG_IS_MOLPRO) in get_file_frome_remote_host()6403 case PROG_IS_MOLPRO : in create_run()
232 else if(data->itype == PROG_IS_MOLPRO) in set_fileopen()670 data->itype == PROG_IS_MOLPRO || data->itype == PROG_IS_MPQC in create_set_dialogue_window()702 case PROG_IS_MOLPRO : in create_set_dialogue_window()1000 || data->itype == PROG_IS_MOLPRO in create_remote_frame_popup()1068 case PROG_IS_MOLPRO : in create_remote_frame_popup()1144 || data->itype == PROG_IS_MOLPRO in create_local_frame_popup()1198 case PROG_IS_MOLPRO : in create_local_frame_popup()1789 if(iprogram == PROG_IS_MOLPRO ) read_geom_in_molpro_input(NomFichier); in get_doc_no_add_list()
1490 else if(iprogram == PROG_IS_MOLPRO) fileopen.command=g_strdup(NameCommandMolpro); in get_doc()1557 if(iprogram == PROG_IS_MOLPRO) in get_doc()1610 else if( iprogram == PROG_IS_MOLPRO) read_geom_in_molpro_input(NomFichier); in get_doc()1719 else if(iprogram == PROG_IS_MOLPRO) fileopen.command=g_strdup(NameCommandMolpro); in enreg_selec_doc()1815 else if(iprogram == PROG_IS_MOLPRO) in enreg_selec_doc()1878 iprogram = PROG_IS_MOLPRO; in new_doc_molpro()2638 iprogram = PROG_IS_MOLPRO; in new_molpro()3073 if( iprogram == PROG_IS_MOLPRO) in draw_density_orbitals_gamess_or_gauss_or_molcas_or_molpro()
2637 if(iprogram == PROG_IS_MOLPRO) in run_molden()3866 return PROG_IS_MOLPRO; in get_type_of_program()
3228 if(iprogram != PROG_IS_MOLPRO) in addAtom()3433 if(iprogram != PROG_IS_MOLPRO) in EditAtom()3650 if(iprogram != PROG_IS_MOLPRO) in DialogueAdd()3847 if(iprogram != PROG_IS_MOLPRO) in DialogueEdit()6634 case PROG_IS_MOLPRO : in read_ZMatrix_file_no_add_list()7123 case PROG_IS_MOLPRO : in read_ZMatrix_mopac_file_no_add_list()7234 if(iprogram == PROG_IS_MOLPRO) NCr = NUMBER_LIST_ZMATRIX-1; in create_geom_list()
738 case PROG_IS_MOLPRO : in rafresh_interface()
3058 if(iprogram == PROG_IS_MOLPRO) in addAtom()3148 if(iprogram != PROG_IS_MOLPRO) in EditAtom()3393 if(iprogram != PROG_IS_MOLPRO) in DialogueAdd()3556 if(iprogram != PROG_IS_MOLPRO) in DialogueEdit()14613 if(iprogram == PROG_IS_MOLPRO) NCr = NUMBER_LIST_XYZ-1; in create_geomXYZ_list()
3217 if( iprogram == PROG_IS_MOLPRO) find_energy_molpro_log(fileName); in find_energy_all()