Changes in src/builder.cpp [99fcaf:4eb4fe]
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src/builder.cpp
r99fcaf r4eb4fe 1494 1494 */ 1495 1495 static int ParseCommandLineOptions(int argc, char **argv, MoleculeListClass *&molecules, periodentafel *&periode, 1496 config& configuration, char *&ConfigFileName, list<int> &ArgcList)1496 config& configuration, char *&ConfigFileName, set<int> &ArgcList) 1497 1497 { 1498 1498 Vector x,y,z,n; // coordinates for absolute point in cell volume … … 1525 1525 case 'H': 1526 1526 case '?': 1527 ArgcList. push_back(argptr-1);1527 ArgcList.insert(argptr-1); 1528 1528 return(1); 1529 1529 break; 1530 1530 case 'v': 1531 ArgcList. push_back(argptr-1);1531 ArgcList.insert(argptr-1); 1532 1532 return(1); 1533 1533 break; 1534 1534 case 'V': 1535 ArgcList. push_back(argptr-1);1536 ArgcList. push_back(argptr);1535 ArgcList.insert(argptr-1); 1536 ArgcList.insert(argptr); 1537 1537 argptr++; 1538 1538 break; … … 2499 2499 char **Arguments = NULL; 2500 2500 int ArgcSize = 0; 2501 int ExitFlag = 0;2502 2501 bool ArgumentsCopied = false; 2503 2502 2503 // print version check whether arguments are present at all 2504 2504 cout << ESPACKVersion << endl; 2505 if (argc < 2) { 2506 cout << "Obtain help with " << argv[0] << " -h." << endl; 2507 return(1); 2508 } 2509 2505 2510 2506 2511 setVerbosity(0); … … 2510 2515 // Parse command line options and if present create respective UI 2511 2516 { 2512 list<int> ArgcList;2513 ArgcList. push_back(0); // push back program!2514 ArgcList. push_back(1); // push back config file name2517 set<int> ArgcList; 2518 ArgcList.insert(0); // push back program! 2519 ArgcList.insert(1); // push back config file name 2515 2520 char ConfigFileName[MAXSTRINGSIZE]; 2516 2521 // handle arguments by ParseCommandLineOptions() 2517 ExitFlag =ParseCommandLineOptions(argc,argv,World::getInstance().getMolecules(),World::getInstance().getPeriode(),*World::getInstance().getConfig(), (char *&)ConfigFileName, ArgcList);2522 ParseCommandLineOptions(argc,argv,World::getInstance().getMolecules(),World::getInstance().getPeriode(),*World::getInstance().getConfig(), (char *&)ConfigFileName, ArgcList); 2518 2523 // copy all remaining arguments to a new argv 2519 2524 Arguments = Malloc<char *>(ArgcList.size(), "main - **Arguments"); 2520 2525 cout << "The following arguments are handled by CommandLineParser: "; 2521 for ( list<int>::iterator ArgcRunner = ArgcList.begin(); ArgcRunner != ArgcList.end(); ++ArgcRunner) {2526 for (set<int>::iterator ArgcRunner = ArgcList.begin(); ArgcRunner != ArgcList.end(); ++ArgcRunner) { 2522 2527 Arguments[ArgcSize] = Malloc<char>(strlen(argv[*ArgcRunner])+2, "main - *Arguments[]"); 2523 2528 strcpy(Arguments[ArgcSize], argv[*ArgcRunner]); … … 2560 2565 cleanUp(); 2561 2566 Memory::getState(); 2562 return ( ExitFlag == 1 ? 0 : ExitFlag);2567 return (0); 2563 2568 } 2564 2569
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