Searched refs:NameCommandMopac (Results 1 – 9 of 9) sorted by relevance
| /dports/science/gabedit/GabeditSrc251_300720/src/Common/ |
| H A D | Global.h | 164 gchar *NameCommandMopac; variable
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| H A D | Preferences.c | 772 NameCommandMopac = g_strdup(mopacCommands.commands[0]); in remove_mopac_command()
774 str_delete_n(NameCommandMopac); in remove_mopac_command()
775 delete_last_spaces(NameCommandMopac); in remove_mopac_command()
776 delete_first_spaces(NameCommandMopac); in remove_mopac_command()
787 NameCommandMopac = g_strdup(strcom); in modify_mopac_command()
789 str_delete_n(NameCommandMopac); in modify_mopac_command()
790 delete_last_spaces(NameCommandMopac); in modify_mopac_command()
791 delete_first_spaces(NameCommandMopac); in modify_mopac_command()
795 if(strcmp(NameCommandMopac,mopacCommands.commands[i])==0) in modify_mopac_command()
802 mopacCommands.commands[mopacCommands.numberOfCommands-1] = g_strdup(NameCommandMopac); in modify_mopac_command()
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| H A D | Run.c | 362 gtk_entry_set_text (GTK_ENTRY (EntryCommand), NameCommandMopac); in set_default_entrys()
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| /dports/science/gabedit/GabeditSrc251_300720/src/Mopac/ |
| H A D | Mopac.c | 120 fileopen.command=g_strdup(NameCommandMopac); in putInfoInTextEditor()
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| /dports/science/gabedit/GabeditSrc251_300720/src/SemiEmpirical/ |
| H A D | SemiEmpirical.c | 282 fprintf(fileSH,"%s %s\n",NameCommandMopac,fileNameIn); in runOneMopac()
288 fprintf(fileSH,"\"%s\" \"%s\"\n",NameCommandMopac,fileNameIn); in runOneMopac()
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| H A D | SemiEmpiricalDlg.c | 454 fprintf(fileSH,"%s %s\n",NameCommandMopac,fileNameIn); in runOneMopac()
460 fprintf(fileSH,"\"%s\" \"%s\"\n",NameCommandMopac,fileNameIn); in runOneMopac()
3498 fprintf(fileSH,"%s %s\n",NameCommandMopac,fileNameIn); in runOneOptMopac()
3504 fprintf(fileSH,"\"%s\" \"%s\"\n",NameCommandMopac,fileNameIn); in runOneOptMopac()
4156 fprintf(fileSH,"%s %s\n",NameCommandMopac,fileName); in createMopacFiles()
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| /dports/science/gabedit/GabeditSrc251_300720/src/Utils/ |
| H A D | Utils.c | 1291 str_delete_n(NameCommandMopac); in create_commands_file()
1292 delete_last_spaces(NameCommandMopac); in create_commands_file()
1293 delete_first_spaces(NameCommandMopac); in create_commands_file()
1294 fprintf(fd,"%s\n",NameCommandMopac); in create_commands_file()
1874 …readCommandsOneSoft(fd, "Begin Mopac", &NameCommandMopac, &mopacCommands, free_mopac_commands, "no… in read_commands_file()
2297 NameCommandMopac=g_strdup("MOPAC2009"); in initialise_name_commands()
2311 NameCommandMopac=g_strdup("/opt/mopac/MOPAC2009.exe"); in initialise_name_commands()
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| H A D | UtilsInterface.c | 1493 else if(iprogram == PROG_IS_MOPAC) fileopen.command=g_strdup(NameCommandMopac); in get_doc()
1945 fileopen.command=g_strdup(NameCommandMopac); in new_doc_mopac()
2829 fileopen.command=g_strdup(NameCommandMopac); in new_mopac()
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| /dports/science/gabedit/GabeditSrc251_300720/src/MolecularMechanics/ |
| H A D | MolecularMechanicsDlg.c | 211 fprintf(fileSH,"%s %s\n",NameCommandMopac,fileName); in createMopacFiles()
604 fprintf(fileSH,"%s %s\n",NameCommandMopac,fileNameIn); in runOneMopac()
610 fprintf(fileSH,"\"%s\" \"%s\"\n",NameCommandMopac,fileNameIn); in runOneMopac()
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