| [f4d063] | 1 | /*
 | 
|---|
 | 2 |  * Project: MoleCuilder
 | 
|---|
 | 3 |  * Description: creates and alters molecular systems
 | 
|---|
| [0aa122] | 4 |  * Copyright (C)  2010-2012 University of Bonn. All rights reserved.
 | 
|---|
| [94d5ac6] | 5 |  * 
 | 
|---|
 | 6 |  *
 | 
|---|
 | 7 |  *   This file is part of MoleCuilder.
 | 
|---|
 | 8 |  *
 | 
|---|
 | 9 |  *    MoleCuilder is free software: you can redistribute it and/or modify
 | 
|---|
 | 10 |  *    it under the terms of the GNU General Public License as published by
 | 
|---|
 | 11 |  *    the Free Software Foundation, either version 2 of the License, or
 | 
|---|
 | 12 |  *    (at your option) any later version.
 | 
|---|
 | 13 |  *
 | 
|---|
 | 14 |  *    MoleCuilder is distributed in the hope that it will be useful,
 | 
|---|
 | 15 |  *    but WITHOUT ANY WARRANTY; without even the implied warranty of
 | 
|---|
 | 16 |  *    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
 | 
|---|
 | 17 |  *    GNU General Public License for more details.
 | 
|---|
 | 18 |  *
 | 
|---|
 | 19 |  *    You should have received a copy of the GNU General Public License
 | 
|---|
 | 20 |  *    along with MoleCuilder.  If not, see <http://www.gnu.org/licenses/>.
 | 
|---|
| [f4d063] | 21 |  */
 | 
|---|
 | 22 | 
 | 
|---|
 | 23 | /*
 | 
|---|
 | 24 |  * builder_init.cpp
 | 
|---|
 | 25 |  *
 | 
|---|
 | 26 |  *  Created on: Dec 15, 2010
 | 
|---|
 | 27 |  *      Author: heber
 | 
|---|
 | 28 |  */
 | 
|---|
 | 29 | 
 | 
|---|
 | 30 | // include config.h
 | 
|---|
 | 31 | #ifdef HAVE_CONFIG_H
 | 
|---|
 | 32 | #include <config.h>
 | 
|---|
 | 33 | #endif
 | 
|---|
 | 34 | 
 | 
|---|
| [14de8e1] | 35 | // boost::python uses placement new which is incompatible with MemDebug.
 | 
|---|
 | 36 | #ifdef HAVE_PYTHON
 | 
|---|
| [7e3f11a] | 37 | #include "Python/PythonScripting.hpp"
 | 
|---|
| [14de8e1] | 38 | #endif
 | 
|---|
 | 39 | 
 | 
|---|
| [9eb71b3] | 40 | //#include "CodePatterns/MemDebug.hpp"
 | 
|---|
| [f4d063] | 41 | 
 | 
|---|
| [14de8e1] | 42 | #include <boost/filesystem.hpp>
 | 
|---|
 | 43 | #include <fstream>
 | 
|---|
| [862b6a] | 44 | #include <iomanip>
 | 
|---|
| [4e855e] | 45 | #include <iostream>
 | 
|---|
| [14de8e1] | 46 | #include <iterator>
 | 
|---|
| [7d0a4e] | 47 | #ifdef HAVE_PTHREAD
 | 
|---|
 | 48 | #include "ThreadGuard.hpp"
 | 
|---|
 | 49 | #endif
 | 
|---|
| [14de8e1] | 50 | #include <string>
 | 
|---|
| [4e855e] | 51 | 
 | 
|---|
| [949953] | 52 | #include "Actions/ActionExceptions.hpp"
 | 
|---|
 | 53 | 
 | 
|---|
 | 54 | #include "builder_init.hpp"
 | 
|---|
 | 55 | #include "cleanUp.hpp"
 | 
|---|
| [f4d063] | 56 | 
 | 
|---|
| [862b6a] | 57 | #include "CodePatterns/Log.hpp"
 | 
|---|
| [949953] | 58 | 
 | 
|---|
| [748fc7] | 59 | //#include "Graph/BondGraph.hpp"
 | 
|---|
| [949953] | 60 | 
 | 
|---|
 | 61 | #include "UIElements/UIFactory.hpp"
 | 
|---|
| [862b6a] | 62 | #include "UIElements/CommandLineUI/CommandLineParser.hpp"
 | 
|---|
| [949953] | 63 | #include "UIElements/CommandLineUI/CommandLineUIFactory.hpp"
 | 
|---|
| [862b6a] | 64 | #ifdef USE_GUI_QT
 | 
|---|
 | 65 | #include "UIElements/Qt4/QtUIFactory.hpp"
 | 
|---|
 | 66 | #endif
 | 
|---|
 | 67 | #include "UIElements/TextUI/TextUIFactory.hpp"
 | 
|---|
| [949953] | 68 | #include "UIElements/MainWindow.hpp"
 | 
|---|
| [f4d063] | 69 | 
 | 
|---|
 | 70 | #include "version.h"
 | 
|---|
 | 71 | 
 | 
|---|
| [5ca6b5] | 72 | #include <boost/filesystem.hpp>
 | 
|---|
 | 73 | 
 | 
|---|
| [f4d063] | 74 | /** Print some initial information output the program.
 | 
|---|
 | 75 |  *
 | 
|---|
 | 76 |  */
 | 
|---|
 | 77 | void ProgramHeader()
 | 
|---|
 | 78 | {
 | 
|---|
 | 79 |   // print version check and copyright notice
 | 
|---|
 | 80 |   cout << MOLECUILDERVERSION << endl;
 | 
|---|
 | 81 |   cout << "MoleCuilder comes with ABSOLUTELY NO WARRANTY; for details type" << endl;
 | 
|---|
 | 82 |   cout << "`molecuilder --warranty'." << endl;
 | 
|---|
| [1795c9] | 83 |   cout << "MoleCuilder - to create and alter molecular systems." << endl;
 | 
|---|
| [94d5ac6] | 84 |   cout << "Copyright (C) 2008-2012  University Bonn. All rights reserved." << endl;
 | 
|---|
| [d32f60] | 85 |   cout << "Copyright (C) 2013-2016  Frederik Heber. All rights reserved." << endl;
 | 
|---|
| [94d5ac6] | 86 |   cout << "This is free software, and you are welcome to redistribute it under" << endl;
 | 
|---|
 | 87 |   cout << "certain conditions; type `molecuilder --help-redistribute' for details" << endl;
 | 
|---|
| [ad7270] | 88 |   cout << endl;
 | 
|---|
| [f4d063] | 89 | }
 | 
|---|
 | 90 | 
 | 
|---|
| [7d0a4e] | 91 | #ifdef HAVE_PTHREAD
 | 
|---|
 | 92 | pthread_t actionqueue_global_threadid = 0;
 | 
|---|
 | 93 | #endif
 | 
|---|
 | 94 | 
 | 
|---|
| [f4d063] | 95 | /** General stuff to intialize before UI.
 | 
|---|
 | 96 |  *
 | 
|---|
 | 97 |  */
 | 
|---|
 | 98 | void initGeneral()
 | 
|---|
 | 99 | {
 | 
|---|
 | 100 |   // while we are non interactive, we want to abort from asserts
 | 
|---|
 | 101 |   ASSERT_DO(Assert::Abort);
 | 
|---|
 | 102 |   ASSERT_HOOK(dumpMemory);
 | 
|---|
 | 103 | 
 | 
|---|
 | 104 |   ProgramHeader();
 | 
|---|
 | 105 | 
 | 
|---|
| [ad7270] | 106 |   setVerbosity(1);
 | 
|---|
| [f4d063] | 107 | 
 | 
|---|
| [7d0a4e] | 108 | #ifdef HAVE_PTHREAD
 | 
|---|
 | 109 |   actionqueue_global_threadid = pthread_self();
 | 
|---|
 | 110 | #endif
 | 
|---|
 | 111 | 
 | 
|---|
| [f4d063] | 112 |   // from this moment on, we need to be sure to deeinitialize in the correct order
 | 
|---|
 | 113 |   // this is handled by the cleanup function
 | 
|---|
 | 114 |   atexit(cleanUp);
 | 
|---|
 | 115 | }
 | 
|---|
 | 116 | 
 | 
|---|
 | 117 | /** Initialize specific UIFactory.
 | 
|---|
 | 118 |  *
 | 
|---|
 | 119 |  * @param argc argument count
 | 
|---|
 | 120 |  * @param argv argument array
 | 
|---|
 | 121 |  */
 | 
|---|
 | 122 | void initUI(int argc, char **argv)
 | 
|---|
 | 123 | {
 | 
|---|
| [748fc7] | 124 |   //std::string BondGraphFileName("\n");
 | 
|---|
| [f4d063] | 125 |   // Parse command line options and if present create respective UI
 | 
|---|
 | 126 |   // construct bond graph
 | 
|---|
| [748fc7] | 127 |   //if (boost::filesystem::exists(BondGraphFileName)) {
 | 
|---|
 | 128 |   //  std::ifstream input(BondGraphFileName.c_str());
 | 
|---|
 | 129 |   //  if ((input.good()) && (World::getInstance().getBondGraph()->LoadBondLengthTable(input))) {
 | 
|---|
 | 130 |   //    LOG(0, "Bond length table loaded successfully.");
 | 
|---|
 | 131 |   //  } else {
 | 
|---|
 | 132 |   //    ELOG(1, "Bond length table loading failed.");
 | 
|---|
 | 133 |   //  }
 | 
|---|
 | 134 |   //  input.close();
 | 
|---|
 | 135 |   //}
 | 
|---|
| [14de8e1] | 136 | 
 | 
|---|
| [f4d063] | 137 |   // handle remaining arguments by CommandLineParser
 | 
|---|
| [3054689] | 138 |   // first argument of "--test" initializes special molecuilder gui test mode
 | 
|---|
 | 139 |   if ((argc>1)
 | 
|---|
 | 140 | #ifdef USE_GUI_QT
 | 
|---|
 | 141 |       && !QtUIFactory::isTestMode(argv[1])
 | 
|---|
 | 142 | #endif
 | 
|---|
 | 143 |   ) {
 | 
|---|
| [47d041] | 144 |     LOG(0, "Setting UI to CommandLine.");
 | 
|---|
| [f4d063] | 145 |     CommandLineParser::getInstance().InitializeCommandArguments();
 | 
|---|
 | 146 |     CommandLineParser::getInstance().Run(argc,argv);
 | 
|---|
 | 147 |     UIFactory::registerFactory(new CommandLineUIFactory::description());
 | 
|---|
 | 148 |     UIFactory::makeUserInterface("CommandLine");
 | 
|---|
 | 149 |   } else {
 | 
|---|
 | 150 |     // In the interactive mode, we can leave the user the choice in case of error
 | 
|---|
 | 151 |     #ifdef USE_GUI_QT
 | 
|---|
| [3054689] | 152 |     if ((argc>1) && (QtUIFactory::isTestMode(argv[1])))
 | 
|---|
 | 153 |       ASSERT_DO(Assert::Abort);
 | 
|---|
 | 154 |     else
 | 
|---|
 | 155 |       ASSERT_DO(Assert::Ask);
 | 
|---|
| [47d041] | 156 |       LOG(0, "Setting UI to Qt4.");
 | 
|---|
| [15e197] | 157 |       UIFactory::registerFactory(new QtUIFactory::description(argc, argv));
 | 
|---|
| [f4d063] | 158 |       UIFactory::makeUserInterface("Qt4");
 | 
|---|
 | 159 |     #else
 | 
|---|
| [3054689] | 160 |       ASSERT_DO(Assert::Ask);
 | 
|---|
| [47d041] | 161 |       LOG(0, "Setting UI to Text.");
 | 
|---|
| [f4d063] | 162 |       cout << MOLECUILDERVERSION << endl;
 | 
|---|
 | 163 |       UIFactory::registerFactory(new TextUIFactory::description());
 | 
|---|
 | 164 |       UIFactory::makeUserInterface("Text");
 | 
|---|
 | 165 |     #endif
 | 
|---|
 | 166 |   }
 | 
|---|
 | 167 | }
 | 
|---|
 | 168 | 
 | 
|---|
 | 169 | /** Create MainWindow and displays.
 | 
|---|
 | 170 |  * I.e. here all the Actions are parsed and done.
 | 
|---|
 | 171 |  */
 | 
|---|
 | 172 | void doUI()
 | 
|---|
 | 173 | {
 | 
|---|
 | 174 |   MainWindow *mainWindow = UIFactory::getInstance().makeMainWindow();
 | 
|---|
| [28864c] | 175 | 
 | 
|---|
 | 176 |   // wait till is done initializing
 | 
|---|
 | 177 |   while (!UIFactory::isDoneInitializing());
 | 
|---|
 | 178 | 
 | 
|---|
 | 179 |   LOG(0, "UI is done initializing.");
 | 
|---|
 | 180 | 
 | 
|---|
| [687ef1] | 181 |   // if we have python, autoexecute a molecuilder script in current folder
 | 
|---|
 | 182 | #ifdef HAVE_PYTHON
 | 
|---|
 | 183 |   const boost::filesystem::path pythonfilename("./molecuilder.py");
 | 
|---|
 | 184 |   executePythonScriptFile(pythonfilename);
 | 
|---|
 | 185 | #endif
 | 
|---|
 | 186 | 
 | 
|---|
| [0d4168] | 187 |   mainWindow->display();
 | 
|---|
| [28864c] | 188 | 
 | 
|---|
| [f4d063] | 189 |   delete mainWindow;
 | 
|---|
 | 190 | }
 | 
|---|
 | 191 | 
 | 
|---|