| [bcf653] | 1 | /* | 
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|  | 2 | * Project: MoleCuilder | 
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|  | 3 | * Description: creates and alters molecular systems | 
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| [0aa122] | 4 | * Copyright (C)  2010-2012 University of Bonn. All rights reserved. | 
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| [94d5ac6] | 5 | * | 
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|  | 6 | * | 
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|  | 7 | *   This file is part of MoleCuilder. | 
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|  | 8 | * | 
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|  | 9 | *    MoleCuilder is free software: you can redistribute it and/or modify | 
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|  | 10 | *    it under the terms of the GNU General Public License as published by | 
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|  | 11 | *    the Free Software Foundation, either version 2 of the License, or | 
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|  | 12 | *    (at your option) any later version. | 
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|  | 13 | * | 
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|  | 14 | *    MoleCuilder is distributed in the hope that it will be useful, | 
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|  | 15 | *    but WITHOUT ANY WARRANTY; without even the implied warranty of | 
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|  | 16 | *    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the | 
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|  | 17 | *    GNU General Public License for more details. | 
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|  | 18 | * | 
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|  | 19 | *    You should have received a copy of the GNU General Public License | 
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|  | 20 | *    along with MoleCuilder.  If not, see <http://www.gnu.org/licenses/>. | 
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| [bcf653] | 21 | */ | 
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|  | 22 |  | 
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| [b47bfc] | 23 | /* | 
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| [3c53fa] | 24 | * QtInfoBox.cpp | 
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| [b47bfc] | 25 | * | 
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|  | 26 | *  Created on: Mar 4, 2010 | 
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|  | 27 | *      Author: crueger | 
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|  | 28 | */ | 
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|  | 29 |  | 
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| [bf3817] | 30 | // include config.h | 
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|  | 31 | #ifdef HAVE_CONFIG_H | 
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|  | 32 | #include <config.h> | 
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|  | 33 | #endif | 
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| [bbbad5] | 34 |  | 
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| [3c53fa] | 35 | #include "Views/Qt4/QtInfoBox.hpp" | 
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| [b47bfc] | 36 |  | 
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|  | 37 | #include <iostream> | 
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| [4f7473] | 38 | #include <QAbstractItemView> | 
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| [b47bfc] | 39 |  | 
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| [ad011c] | 40 | #include "CodePatterns/MemDebug.hpp" | 
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| [bbbad5] | 41 |  | 
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| [367489] | 42 | #include "UIElements/Qt4/InstanceBoard/QtObservedInstanceBoard.hpp" | 
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| [e7341e] | 43 |  | 
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| [cf9287] | 44 | #include <boost/thread/locks.hpp> | 
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|  | 45 |  | 
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| [4f7473] | 46 | #include "Element/element.hpp" | 
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| [367489] | 47 | #include "Element/periodentafel.hpp" | 
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| [e7341e] | 48 | #include "World.hpp" | 
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| [b47bfc] | 49 |  | 
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|  | 50 | using namespace std; | 
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|  | 51 |  | 
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|  | 52 | /***************** Basic structure for tab layout ***********/ | 
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|  | 53 |  | 
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| [b2c2e4] | 54 | QtInfoBox::QtInfoBox(QtObservedInstanceBoard *_board, QWidget *_parent) : | 
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|  | 55 | QTabWidget(_parent), | 
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| [e7341e] | 56 | curAtomId(-1), nextAtomId(-1), | 
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|  | 57 | curMoleculeId(-1), nextMoleculeId(-1), | 
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| [367489] | 58 | page_mol(NULL), page_atom(NULL), | 
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|  | 59 | board(_board), | 
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|  | 60 | currentPage(0), | 
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|  | 61 | periode(World::getInstance().getPeriode()) | 
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| [b47bfc] | 62 | { | 
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| [4a2f3e] | 63 | timer = new QTimer(this); | 
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|  | 64 | timer->setSingleShot(true); | 
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| [b47bfc] | 65 |  | 
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| [0b2be1] | 66 | setMinimumWidth(200); | 
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| [5dcb3c] | 67 | setMinimumHeight(220); | 
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| [0b2be1] | 68 |  | 
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| [4a2f3e] | 69 | connect(timer, SIGNAL(timeout()), this, SLOT(timerTimeout())); | 
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| [b47bfc] | 70 | } | 
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|  | 71 |  | 
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| [3c53fa] | 72 | QtInfoBox::~QtInfoBox() | 
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| [be374a] | 73 | { | 
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| [cf9287] | 74 | clearAtomTab(); | 
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|  | 75 | clearMoleculeTab(); | 
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| [be374a] | 76 | } | 
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| [b47bfc] | 77 |  | 
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| [e7341e] | 78 | void QtInfoBox::atomHover(const atomId_t _id) | 
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| [4a2f3e] | 79 | { | 
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| [e7341e] | 80 | nextAtomId = _id; | 
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| [2b596f] | 81 | timer->start(500); | 
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|  | 82 | } | 
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|  | 83 |  | 
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| [e7341e] | 84 | void QtInfoBox::moleculeHover(const moleculeId_t _id) | 
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| [2b596f] | 85 | { | 
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| [e7341e] | 86 | nextMoleculeId = _id; | 
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| [4a2f3e] | 87 | timer->start(500); | 
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| [b47bfc] | 88 | } | 
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|  | 89 |  | 
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| [3c53fa] | 90 | void QtInfoBox::timerTimeout() | 
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| [4a2f3e] | 91 | { | 
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| [e7341e] | 92 | if (nextAtomId != (atomId_t)-1) | 
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|  | 93 | showAtom(nextAtomId); | 
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|  | 94 | if (nextMoleculeId != (moleculeId_t)-1) | 
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|  | 95 | showMolecule(nextMoleculeId); | 
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| [b47bfc] | 96 | } | 
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|  | 97 |  | 
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| [cf9287] | 98 | void QtInfoBox::clearAtomTab() | 
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| [7b6bcfe] | 99 | { | 
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| [cf9287] | 100 | boost::recursive_mutex::scoped_lock lock(tabs_mutex); | 
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| [7b6bcfe] | 101 | if (page_atom){ | 
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| [50246c] | 102 | if (page_atom->getAtom()) | 
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|  | 103 | disconnect(page_atom->getAtom().get(), SIGNAL(atomRemoved()), this, SLOT(clearAtomTab())); | 
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| [be374a] | 104 | //removeTab(indexOf(page_atom)); | 
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| [7b6bcfe] | 105 | delete(page_atom); | 
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|  | 106 | page_atom = NULL; | 
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|  | 107 | } | 
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| [cf9287] | 108 | } | 
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|  | 109 |  | 
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|  | 110 | void QtInfoBox::clearMoleculeTab() | 
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|  | 111 | { | 
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|  | 112 | boost::recursive_mutex::scoped_lock lock(tabs_mutex); | 
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| [7b6bcfe] | 113 | if (page_mol){ | 
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| [50246c] | 114 | if (page_mol->getMolecule()) | 
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|  | 115 | disconnect(page_mol->getMolecule().get(), SIGNAL(moleculeRemoved()), this, SLOT(clearMoleculeTab())); | 
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| [be374a] | 116 | //removeTab(indexOf(page_mol)); | 
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| [7b6bcfe] | 117 | delete(page_mol); | 
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|  | 118 | page_mol = NULL; | 
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|  | 119 | } | 
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| [be374a] | 120 | } | 
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| [7b6bcfe] | 121 |  | 
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| [e7341e] | 122 | void QtInfoBox::showAtom(const atomId_t _id) | 
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| [be374a] | 123 | { | 
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| [52575c] | 124 | currentPage = currentIndex(); | 
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|  | 125 |  | 
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| [be374a] | 126 | // Remove old tabs. | 
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| [cf9287] | 127 | clearAtomTab(); | 
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|  | 128 | clearMoleculeTab(); | 
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| [be374a] | 129 |  | 
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| [367489] | 130 | QtObservedAtom::ptr curAtom = board->getObservedAtom(_id); | 
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| [7b6bcfe] | 131 |  | 
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|  | 132 | // Show new tabs. | 
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| [4a2f3e] | 133 | if (curAtom){ | 
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| [367489] | 134 | curAtomId = curAtom->getAtomIndex(); | 
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|  | 135 | nextAtomId = -1; | 
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|  | 136 | nextMoleculeId = -1; | 
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| [4f7473] | 137 |  | 
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| [cf9287] | 138 | boost::recursive_mutex::scoped_lock lock(tabs_mutex); | 
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| [367489] | 139 | page_atom = new QtAtomInfoPage(curAtom, periode, this); | 
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|  | 140 | addTab(page_atom, "Atom"); | 
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| [cf9287] | 141 | connect(curAtom.get(), SIGNAL(atomRemoved()), this, SLOT(clearAtomTab())); | 
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| [367489] | 142 |  | 
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| [273c8a] | 143 | if (curAtom->getMoleculeRef() != NULL) { | 
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|  | 144 | QtObservedMolecule::ptr curMolecule = curAtom->getMoleculeRef()->getRef(); | 
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| [367489] | 145 | if (curMolecule) { | 
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|  | 146 | page_mol = new QtMoleculeInfoPage(curMolecule, this); | 
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|  | 147 | addTab(page_mol, "Molecule"); | 
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|  | 148 | connect(curMolecule.get(), SIGNAL(moleculeRemoved()), this, SLOT(clearMoleculeTab())); | 
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|  | 149 |  | 
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|  | 150 | if (currentPage > 0) | 
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|  | 151 | setCurrentIndex(currentPage); | 
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|  | 152 | } | 
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| [7772aa] | 153 | } | 
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| [7b6bcfe] | 154 | } | 
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|  | 155 | } | 
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|  | 156 |  | 
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| [e7341e] | 157 | void QtInfoBox::showMolecule(const moleculeId_t _id) | 
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| [2b596f] | 158 | { | 
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|  | 159 | currentPage = currentIndex(); | 
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|  | 160 |  | 
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|  | 161 | // Remove old tabs. | 
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| [cf9287] | 162 | clearAtomTab(); | 
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|  | 163 | clearMoleculeTab(); | 
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| [2b596f] | 164 |  | 
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| [367489] | 165 | QtObservedMolecule::ptr curMolecule = board->getObservedMolecule(_id); | 
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| [e7341e] | 166 | nextAtomId = -1; | 
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|  | 167 | nextMoleculeId = -1; | 
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| [2b596f] | 168 |  | 
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|  | 169 | // Show new tabs. | 
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|  | 170 | if (curMolecule){ | 
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| [cf9287] | 171 | boost::recursive_mutex::scoped_lock lock(tabs_mutex); | 
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| [2b596f] | 172 | page_mol = new QtMoleculeInfoPage(curMolecule, this); | 
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|  | 173 | addTab(page_mol, "Molecule"); | 
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| [cf9287] | 174 | connect(curMolecule.get(), SIGNAL(moleculeRemoved()), this, SLOT(clearMoleculeTab())); | 
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| [2b596f] | 175 |  | 
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|  | 176 | if (currentPage > 0) | 
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|  | 177 | setCurrentIndex(currentPage); | 
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|  | 178 | } | 
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|  | 179 | } | 
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|  | 180 |  | 
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| [7b6bcfe] | 181 | /************************ Tab for single Atoms ********************/ | 
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| [b47bfc] | 182 |  | 
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| [4f7473] | 183 | static void addInfo(QTreeWidget *info, const QString &key, const QString &value) | 
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|  | 184 | { | 
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|  | 185 | QTreeWidgetItem *treeItem = new QTreeWidgetItem(info); | 
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|  | 186 | treeItem->setText(0, key); | 
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|  | 187 | treeItem->setText(1, value); | 
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|  | 188 | } | 
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|  | 189 |  | 
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| [367489] | 190 | QtAtomInfoPage::QtAtomInfoPage( | 
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|  | 191 | QtObservedAtom::ptr &_atom, | 
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|  | 192 | periodentafel *_periode, | 
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|  | 193 | QWidget *parent) : | 
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| [0b2be1] | 194 | QTreeWidget(parent), | 
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| [367489] | 195 | atomRef(_atom), | 
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|  | 196 | periode(_periode) | 
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| [7b6bcfe] | 197 | { | 
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| [0b2be1] | 198 | setColumnCount(2); | 
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| [4f7473] | 199 | QStringList header; | 
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|  | 200 | header << "data"; | 
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|  | 201 | header << "value"; | 
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| [0b2be1] | 202 | setHeaderLabels(header); | 
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| [4f7473] | 203 |  | 
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| [4965922] | 204 | updatePage(); | 
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|  | 205 | } | 
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|  | 206 |  | 
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|  | 207 | void QtAtomInfoPage::updatePage() | 
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|  | 208 | { | 
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|  | 209 | clear(); | 
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|  | 210 |  | 
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| [2831b3] | 211 | if (atomRef == NULL) | 
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|  | 212 | return; | 
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| [367489] | 213 | const element * const _element = periode->FindElement(atomRef->getAtomElement()); | 
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|  | 214 | addInfo(this, "Name", QString(atomRef->getAtomName().c_str())); | 
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|  | 215 | addInfo(this, "Element", QString(_element->getName().c_str())); | 
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|  | 216 | addInfo(this, "Mass", QString("%1").arg(_element->getMass())); | 
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|  | 217 | addInfo(this, "Charge", QString("%1").arg(_element->getCharge())); | 
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|  | 218 | addInfo(this, "Bonds", QString("%1").arg(atomRef->getAtomBonds().size())); | 
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|  | 219 | addInfo(this, "Position x", QString(toString(atomRef->getAtomPosition()[0]).c_str())); | 
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|  | 220 | addInfo(this, "Position y", QString(toString(atomRef->getAtomPosition()[1]).c_str())); | 
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|  | 221 | addInfo(this, "Position z", QString(toString(atomRef->getAtomPosition()[2]).c_str())); | 
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| [7b6bcfe] | 222 | } | 
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| [b47bfc] | 223 |  | 
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| [3c53fa] | 224 | QtAtomInfoPage::~QtAtomInfoPage() | 
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| [367489] | 225 | {} | 
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| [b47bfc] | 226 |  | 
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|  | 227 | /************************ Tab for single Molecules *****************/ | 
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|  | 228 |  | 
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| [367489] | 229 | QtMoleculeInfoPage::QtMoleculeInfoPage( | 
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|  | 230 | QtObservedMolecule::ptr &_mol, | 
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|  | 231 | QWidget *parent) : | 
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| [0b2be1] | 232 | QTreeWidget(parent), | 
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| [4f7473] | 233 | mol(_mol) | 
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| [b47bfc] | 234 | { | 
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| [0b2be1] | 235 | setColumnCount(2); | 
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| [4f7473] | 236 | QStringList header; | 
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|  | 237 | header << "data"; | 
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|  | 238 | header << "value"; | 
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| [0b2be1] | 239 | setHeaderLabels(header); | 
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| [4f7473] | 240 |  | 
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| [4965922] | 241 | updatePage(); | 
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|  | 242 | } | 
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|  | 243 |  | 
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|  | 244 | void QtMoleculeInfoPage::updatePage() | 
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|  | 245 | { | 
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|  | 246 | clear(); | 
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|  | 247 |  | 
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| [2831b3] | 248 | if (mol == NULL) | 
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|  | 249 | return; | 
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| [367489] | 250 | addInfo(this, "Name", QString(mol->getMolName().c_str())); | 
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|  | 251 | addInfo(this, "Formula", QString(mol->getMolFormula().c_str())); | 
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| [0b2be1] | 252 | addInfo(this, "Atoms", QString("%1").arg(mol->getAtomCount())); | 
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| [367489] | 253 | addInfo(this, "NonHydrogens", QString("%1").arg(mol->getNonHydrogenCount())); | 
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| [0b2be1] | 254 | addInfo(this, "Bonds", QString("%1").arg(mol->getBondCount())); | 
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| [367489] | 255 | const Vector molCenter = mol->getMolCenter(); | 
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| [5dcb3c] | 256 | addInfo(this, "Center x", QString("%1").arg(molCenter[0])); | 
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|  | 257 | addInfo(this, "Center y", QString("%1").arg(molCenter[1])); | 
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|  | 258 | addInfo(this, "Center z", QString("%1").arg(molCenter[2])); | 
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| [b47bfc] | 259 | } | 
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|  | 260 |  | 
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| [367489] | 261 | QtMoleculeInfoPage::~QtMoleculeInfoPage() | 
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|  | 262 | {} | 
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