source: src/UIElements/Qt4/QtMainWindow.cpp@ f62e60

Action_Thermostats Add_AtomRandomPerturbation Add_FitFragmentPartialChargesAction Add_RotateAroundBondAction Add_SelectAtomByNameAction Added_ParseSaveFragmentResults AddingActions_SaveParseParticleParameters Adding_Graph_to_ChangeBondActions Adding_MD_integration_tests Adding_ParticleName_to_Atom Adding_StructOpt_integration_tests AtomFragments Automaking_mpqc_open AutomationFragmentation_failures Candidate_v1.5.4 Candidate_v1.6.0 Candidate_v1.6.1 ChangeBugEmailaddress ChangingTestPorts ChemicalSpaceEvaluator CombiningParticlePotentialParsing Combining_Subpackages Debian_Package_split Debian_package_split_molecuildergui_only Disabling_MemDebug Docu_Python_wait EmpiricalPotential_contain_HomologyGraph EmpiricalPotential_contain_HomologyGraph_documentation Enable_parallel_make_install Enhance_userguide Enhanced_StructuralOptimization Enhanced_StructuralOptimization_continued Example_ManyWaysToTranslateAtom Exclude_Hydrogens_annealWithBondGraph FitPartialCharges_GlobalError Fix_BoundInBox_CenterInBox_MoleculeActions Fix_ChargeSampling_PBC Fix_ChronosMutex Fix_FitPartialCharges Fix_FitPotential_needs_atomicnumbers Fix_ForceAnnealing Fix_IndependentFragmentGrids Fix_ParseParticles Fix_ParseParticles_split_forward_backward_Actions Fix_PopActions Fix_QtFragmentList_sorted_selection Fix_Restrictedkeyset_FragmentMolecule Fix_StatusMsg Fix_StepWorldTime_single_argument Fix_Verbose_Codepatterns Fix_fitting_potentials Fixes ForceAnnealing_goodresults ForceAnnealing_oldresults ForceAnnealing_tocheck ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_continued ForceAnnealing_with_BondGraph_continued_betteresults ForceAnnealing_with_BondGraph_contraction-expansion FragmentAction_writes_AtomFragments FragmentMolecule_checks_bonddegrees GeometryObjects Gui_Fixes Gui_displays_atomic_force_velocity ImplicitCharges IndependentFragmentGrids IndependentFragmentGrids_IndividualZeroInstances IndependentFragmentGrids_IntegrationTest IndependentFragmentGrids_Sole_NN_Calculation JobMarket_RobustOnKillsSegFaults JobMarket_StableWorkerPool JobMarket_unresolvable_hostname_fix MoreRobust_FragmentAutomation ODR_violation_mpqc_open PartialCharges_OrthogonalSummation PdbParser_setsAtomName PythonUI_with_named_parameters QtGui_reactivate_TimeChanged_changes Recreated_GuiChecks Rewrite_FitPartialCharges RotateToPrincipalAxisSystem_UndoRedo SaturateAtoms_findBestMatching SaturateAtoms_singleDegree StoppableMakroAction Subpackage_CodePatterns Subpackage_JobMarket Subpackage_LinearAlgebra Subpackage_levmar Subpackage_mpqc_open Subpackage_vmg Switchable_LogView ThirdParty_MPQC_rebuilt_buildsystem TrajectoryDependenant_MaxOrder TremoloParser_IncreasedPrecision TremoloParser_MultipleTimesteps TremoloParser_setsAtomName Ubuntu_1604_changes stable
Last change on this file since f62e60 was f62e60, checked in by Frederik Heber <heber@…>, 10 years ago

Moved QtMoleculeList files into own subfolder.

  • added QtMoleculeListView.
  • we are going to need a lot of classes for this to work properly.
  • Property mode set to 100644
File size: 6.5 KB
Line 
1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
4 * Copyright (C) 2010-2012 University of Bonn. All rights reserved.
5 * Copyright (C) 2013 Frederik Heber. All rights reserved.
6 *
7 *
8 * This file is part of MoleCuilder.
9 *
10 * MoleCuilder is free software: you can redistribute it and/or modify
11 * it under the terms of the GNU General Public License as published by
12 * the Free Software Foundation, either version 2 of the License, or
13 * (at your option) any later version.
14 *
15 * MoleCuilder is distributed in the hope that it will be useful,
16 * but WITHOUT ANY WARRANTY; without even the implied warranty of
17 * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
18 * GNU General Public License for more details.
19 *
20 * You should have received a copy of the GNU General Public License
21 * along with MoleCuilder. If not, see <http://www.gnu.org/licenses/>.
22 */
23
24/*
25 * QtMainWindow.cpp
26 *
27 * Created on: Jan 14, 2010
28 * Author: crueger
29 */
30
31// include config.h
32#ifdef HAVE_CONFIG_H
33#include <config.h>
34#endif
35
36#include "QtMainWindow.hpp"
37
38#include<Qt/qapplication.h>
39#include<Qt/qlabel.h>
40#include<Qt/qstring.h>
41#include<Qt/qmenubar.h>
42#include<Qt/qsplitter.h>
43#include<Qt/qtoolbar.h>
44#include<Qt/qsettings.h>
45#include<Qt/qmessagebox.h>
46#include<Qt/qboxlayout.h>
47#include<Qt/qevent.h>
48
49#include<iostream>
50#include<map>
51
52#include<boost/bind.hpp>
53
54#include "Menu/Qt4/QtMenu.hpp"
55#include "Views/Qt4/MoleculeList/QtMoleculeList.hpp"
56#include "Views/Qt4/MoleculeList/QtMoleculeListView.hpp"
57#include "Views/Qt4/QtElementList.hpp"
58#include "Views/Qt4/QtFragmentList.hpp"
59#include "Views/Qt4/QtHomologyList.hpp"
60#include "Views/Qt4/QtLogBox.hpp"
61#include "Views/Qt4/QtShapeController.hpp"
62#include "Views/Qt4/QtInfoBox.hpp"
63#include "Views/Qt4/QtStatusBar.hpp"
64#include "Views/Qt4/QtTimeLine.hpp"
65#include "Views/Qt4/QtToolBar.hpp"
66#include "Views/Qt4/Qt3D/GLWorldView.hpp"
67
68#include "CodePatterns/MemDebug.hpp"
69
70#include "Atom/atom.hpp"
71#include "molecule.hpp"
72#include "CodePatterns/Verbose.hpp"
73#include "Actions/Action.hpp"
74#include "Actions/ActionQueue.hpp"
75#include "Parser/ChangeTracker.hpp"
76#include "Parser/FormatParserStorage.hpp"
77#include "Actions/WorldAction/OutputAction.hpp"
78#include "Actions/WorldAction/OutputAsAction.hpp"
79
80
81using namespace MoleCuilder;
82
83QtMainWindow::QtMainWindow(QApplication *_theApp) :
84 theApp(_theApp)
85{
86 Q_INIT_RESOURCE(icons);
87 theApp->setWindowIcon(QIcon(QPixmap(":/molecuildergui_logo.png")));
88 QCoreApplication::setOrganizationName("ins");
89 QCoreApplication::setOrganizationDomain("ins.uni-bonn.de");
90 QCoreApplication::setApplicationName("MoleCuilder");
91 QSplitter *splitter1 = new QSplitter (Qt::Horizontal, this );
92 QSplitter *splitter2 = new QSplitter (Qt::Vertical, splitter1 );
93 QSplitter *splitter3 = new QSplitter (Qt::Vertical, splitter1 );
94 QTabWidget *worldTab = new QTabWidget(splitter2);
95 QWidget *layoutwidget = new QWidget(splitter2);
96 QVBoxLayout *layout = new QVBoxLayout(layoutwidget);
97
98 QtMoleculeListView *moleculeListView = new QtMoleculeListView(worldTab);
99 moleculeList = new QtMoleculeList;
100 moleculeListView->setModel(moleculeList);
101
102 elementList = new QtElementList(worldTab);
103 homologyList = new QtHomologyList(worldTab);
104 fragmentList = new QtFragmentList(worldTab);
105 logBox = new QtLogBox(worldTab);
106 shapeController = new QtShapeController(worldTab);
107
108 timeline = new QtTimeLine(this);
109
110 infoBox = new QtInfoBox();
111 glWorldView = new GLWorldView(this);
112 glWorldView->setSizePolicy( QSizePolicy::Expanding,QSizePolicy::Expanding);
113 glWorldView->setMinimumSize( QSize(640,480) );
114// glWorldView->setFocus();
115 glWorldView->camera()->setEye( QVector3D(0,3,10));
116
117 MainMenu = new QtMenu<QMenuBar>(menuBar(), "");
118 MainMenu->init();
119
120 toolbar = new QtToolBar(this);
121 glWorldView->addToolBarActions(toolbar);
122 toolbar->addFavoriteActionItems(20);
123 addToolBar(toolbar);
124
125 setCentralWidget(splitter1);
126 splitter1->addWidget(splitter2);
127 splitter1->addWidget(splitter3);
128 splitter1->setStretchFactor(0, 10);
129 splitter3->addWidget(infoBox);
130 splitter3->addWidget(shapeController);
131 splitter2->addWidget(glWorldView);
132 layout->addWidget(timeline);
133 layout->addWidget(worldTab);
134 splitter2->addWidget(layoutwidget);
135 worldTab->addTab(moleculeListView, "Molecules");
136 worldTab->addTab(elementList, "All Elements");
137 worldTab->addTab(fragmentList, "All Fragments");
138 worldTab->addTab(homologyList, "All Homologies");
139 worldTab->addTab(logBox, "Log");
140
141 statusBar = new QtStatusBar(this);
142 setStatusBar(statusBar);
143
144 QSettings settings;
145 settings.beginGroup("MainWindow");
146 resize(settings.value("size", QSize(400, 400)).toSize());
147 move(settings.value("position", QPoint(200, 200)).toPoint());
148 if (settings.value("maximized", false).toBool())
149 showMaximized();
150 settings.endGroup();
151
152 qRegisterMetaType<moleculeId_t>("moleculeId_t");
153
154 connect(glWorldView,SIGNAL(hoverChanged(const atom&)), infoBox,SLOT(atomHover(const atom&)));
155 connect(glWorldView,SIGNAL(hoverChanged(const molecule&, int)), infoBox,SLOT(moleculeHover(const molecule&)));
156 connect(moleculeList,SIGNAL(moleculesVisibilityChanged(const moleculeId_t,bool)), glWorldView, SIGNAL(moleculesVisibilityChanged(const moleculeId_t,bool)));
157}
158
159QtMainWindow::~QtMainWindow()
160{
161 QSettings settings;
162 settings.beginGroup("MainWindow");
163 settings.setValue("size", size());
164 settings.setValue("position", pos());
165 settings.setValue("maximized", isMaximized());
166 settings.endGroup();
167
168 menuBar()->clear();
169 delete MainMenu;
170}
171
172void QtMainWindow::display() {
173 this->show();
174 this->update();
175 theApp->exec();
176}
177
178void QtMainWindow::closeEvent(QCloseEvent *event)
179{
180 if (ChangeTracker::getInstance().hasChanged()){
181 int ret = QMessageBox::question(this, tr("MoleCuilder"),
182 tr("The world has been modified.\n"
183 "Do you want to save your changes?"),
184 QMessageBox::Save | QMessageBox::Discard | QMessageBox::Cancel,
185 QMessageBox::Save);
186 switch(ret){
187 case QMessageBox::Cancel:
188 event->ignore();
189 return;
190 case QMessageBox::Save:
191 if (FormatParserStorage::getInstance().isAbleToSave())
192 MoleCuilder::WorldOutput();
193 else{
194 try{
195 ActionQueue::getInstance().queueAction("output-as");
196 }catch(...){
197 ELOG(1, "Action failed or cancelled");
198 }
199 }
200 break;
201 }
202 }
203 QMainWindow::closeEvent(event);
204}
205
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