source: src/UIElements/Qt4/QtMainWindow.cpp@ 43c79a

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 43c79a was 4458b0, checked in by Frederik Heber <heber@…>, 12 years ago

QtShapeList added

  • Property mode set to 100644
File size: 5.1 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 *
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/>.
21 */
22
23/*
24 * QtMainWindow.cpp
25 *
26 * Created on: Jan 14, 2010
27 * Author: crueger
28 */
29
30// include config.h
31#ifdef HAVE_CONFIG_H
32#include <config.h>
33#endif
34
35#include "QtMainWindow.hpp"
36
37#include<Qt/qapplication.h>
38#include<Qt/qlabel.h>
39#include<Qt/qstring.h>
40#include<Qt/qmenubar.h>
41#include<Qt/qsplitter.h>
42#include<Qt/qtoolbar.h>
43#include<Qt/qsettings.h>
44#include<Qt/qmessagebox.h>
45#include<Qt/qevent.h>
46
47#include<iostream>
48#include<map>
49
50#include<boost/bind.hpp>
51
52#include "Menu/Qt4/QtMenu.hpp"
53#include "Views/Qt4/QtMoleculeList.hpp"
54#include "Views/Qt4/QtElementList.hpp"
55#include "Views/Qt4/QtShapeList.hpp"
56#include "Views/Qt4/QtInfoBox.hpp"
57#include "Views/Qt4/QtStatusBar.hpp"
58#include "Views/Qt4/QtToolBar.hpp"
59#include "Views/Qt4/Qt3D/GLWorldView.hpp"
60
61#include "CodePatterns/MemDebug.hpp"
62
63#include "Atom/atom.hpp"
64#include "molecule.hpp"
65#include "CodePatterns/Verbose.hpp"
66#include "Actions/Action.hpp"
67#include "Actions/ActionRegistry.hpp"
68#include "Parser/ChangeTracker.hpp"
69#include "Parser/FormatParserStorage.hpp"
70#include "Actions/WorldAction/OutputAction.hpp"
71#include "Actions/WorldAction/OutputAsAction.hpp"
72
73using namespace MoleCuilder;
74
75QtMainWindow::QtMainWindow(QApplication *_theApp) :
76 theApp(_theApp)
77{
78 QCoreApplication::setOrganizationName("ins");
79 QCoreApplication::setOrganizationDomain("ins.uni-bonn.de");
80 QCoreApplication::setApplicationName("MoleCuilder");
81 QSplitter *splitter1 = new QSplitter (Qt::Horizontal, this );
82 QSplitter *splitter2 = new QSplitter (Qt::Vertical, splitter1 );
83 QSplitter *splitter3 = new QSplitter (Qt::Vertical, splitter1 );
84 QTabWidget *worldTab = new QTabWidget(splitter2);
85
86 moleculeList = new QtMoleculeList(worldTab);
87 elementList = new QtElementList(worldTab);
88 shapeList = new QtShapeList(worldTab);
89
90 infoBox = new QtInfoBox();
91 glWorldView = new GLWorldView(this);
92// glWorldView->setSizePolicy( QSizePolicy::Minimum,QSizePolicy::Minimum);
93 glWorldView->setMinimumSize( QSize(640,480) );
94// glWorldView->setFocus();
95 glWorldView->camera()->setEye( QVector3D(0,3,10));
96
97 MainMenu = new QtMenu<QMenuBar>(menuBar(), "");
98 MainMenu->init();
99
100 toolbar = new QtToolBar(this);
101 glWorldView->addToolBarActions(toolbar);
102 addToolBar(toolbar);
103
104 setCentralWidget(splitter1);
105 splitter1->addWidget(splitter2);
106 splitter1->addWidget(splitter3);
107 splitter1->setStretchFactor(0, 10);
108 splitter3->addWidget(infoBox);
109 splitter3->addWidget(shapeList);
110 splitter2->addWidget(glWorldView);
111 splitter2->addWidget(worldTab);
112 worldTab->addTab(moleculeList, "Molecules");
113 worldTab->addTab(elementList, "All Elements");
114
115 statusBar = new QtStatusBar(this);
116 setStatusBar(statusBar);
117
118 QSettings settings;
119 settings.beginGroup("MainWindow");
120 resize(settings.value("size", QSize(400, 400)).toSize());
121 move(settings.value("position", QPoint(200, 200)).toPoint());
122 if (settings.value("maximized", false).toBool())
123 showMaximized();
124 settings.endGroup();
125
126 connect(glWorldView,SIGNAL(hoverChanged(const atom*)), infoBox,SLOT(atomHover(const atom*)));
127}
128
129QtMainWindow::~QtMainWindow()
130{
131 QSettings settings;
132 settings.beginGroup("MainWindow");
133 settings.setValue("size", size());
134 settings.setValue("position", pos());
135 settings.setValue("maximized", isMaximized());
136 settings.endGroup();
137
138 menuBar()->clear();
139 delete MainMenu;
140}
141
142void QtMainWindow::display() {
143 this->show();
144 theApp->exec();
145}
146
147void QtMainWindow::closeEvent(QCloseEvent *event)
148{
149 if (ChangeTracker::getInstance().hasChanged()){
150 int ret = QMessageBox::question(this, tr("MoleCuilder"),
151 tr("The world has been modified.\n"
152 "Do you want to save your changes?"),
153 QMessageBox::Save | QMessageBox::Discard | QMessageBox::Cancel,
154 QMessageBox::Save);
155 switch(ret){
156 case QMessageBox::Cancel:
157 event->ignore();
158 return;
159 case QMessageBox::Save:
160 if (FormatParserStorage::getInstance().isAbleToSave())
161 MoleCuilder::WorldOutput();
162 else{
163 Action* action = ActionRegistry::getInstance().getActionByName("output-as");
164 try{
165 action->call();
166 }catch(...){
167 ELOG(1, "Action failed or cancelled");
168 }
169 }
170 break;
171 }
172 }
173 QMainWindow::closeEvent(event);
174}
175
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