[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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[0eb7bf3] | 24 | * QtMoleculeList.cpp
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[b47bfc] | 25 | *
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| 26 | * Created on: Jan 21, 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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[0eb7bf3] | 35 | #include "Views/Qt4/QtMoleculeList.hpp"
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[b47bfc] | 36 |
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[41815a3] | 37 | #include <QMetaMethod>
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| 38 |
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[b47bfc] | 39 | #include <iostream>
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| 40 |
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[ad011c] | 41 | #include "CodePatterns/MemDebug.hpp"
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[bbbad5] | 42 |
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[6f0841] | 43 | #include "Atom/atom.hpp"
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[26cf17] | 44 | #include "Formula.hpp"
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[b47bfc] | 45 | #include "molecule.hpp"
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[42127c] | 46 | #include "MoleculeListClass.hpp"
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[b14efe] | 47 | #include "Actions/SelectionAction/Molecules/MoleculeByIdAction.hpp"
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| 48 | #include "Actions/SelectionAction/Molecules/NotMoleculeByIdAction.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 | // maybe this should go with the definition of molecules
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| 53 |
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| 54 | // some attributes need to be easier to find for molecules
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[6cab535] | 55 | // these attributes are skipped so far
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[0eb7bf3] | 56 | const int QtMoleculeList::COLUMNCOUNT = COLUMNTYPES_MAX;
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[739ee9] | 57 | const char *QtMoleculeList::COLUMNNAMES[QtMoleculeList::COLUMNCOUNT]={"Name","Visibility", "Atoms","Formula","Occurrence"/*,"Size"*/};
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[b47bfc] | 58 |
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[0eb7bf3] | 59 | QtMoleculeList::QtMoleculeList(QWidget * _parent) :
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[79b59b] | 60 | QTreeWidget (_parent),
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[0eb7bf3] | 61 | Observer("QtMoleculeList")
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[b47bfc] | 62 | {
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| 63 | setColumnCount(COLUMNCOUNT);
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[79b59b] | 64 | setSelectionMode(QAbstractItemView::MultiSelection);
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[b47bfc] | 65 |
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[79b59b] | 66 | QStringList header;
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| 67 | for(int i=0; i<COLUMNCOUNT;++i)
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| 68 | header << COLUMNNAMES[i];
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| 69 | setHeaderLabels(header);
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[b47bfc] | 70 |
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[3eb91c] | 71 | World::getInstance().signOn(this, World::MoleculeInserted);
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| 72 | World::getInstance().signOn(this, World::MoleculeRemoved);
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[41815a3] | 73 |
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| 74 |
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[a39006] | 75 | dirty = true;
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[99e8ea] | 76 | clearing = false;
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[41815a3] | 77 | selecting = false;
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[3eb91c] | 78 | ChangingChildrensVisibility = false;
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[a39006] | 79 | refill();
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[b47bfc] | 80 |
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[25e18e7] | 81 | qRegisterMetaType<QItemSelection>("QItemSelection");
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[79b59b] | 82 | //connect(this,SIGNAL(cellChanged(int,int)),this,SLOT(moleculeChanged(int,int)));
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[41815a3] | 83 | connect(selectionModel(),SIGNAL(selectionChanged(QItemSelection, QItemSelection)),this,SLOT(rowsSelected(QItemSelection, QItemSelection)));
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[739ee9] | 84 | connect(this, SIGNAL(itemChanged(QTreeWidgetItem*, int)), this, SLOT(visibilityChanged(QTreeWidgetItem*, int)));
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[b47bfc] | 85 | }
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| 86 |
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[0eb7bf3] | 87 | QtMoleculeList::~QtMoleculeList()
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[b47bfc] | 88 | {
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[3eb91c] | 89 | World::getInstance().signOff(this, World::MoleculeInserted);
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| 90 | World::getInstance().signOff(this, World::MoleculeRemoved);
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[b47bfc] | 91 | }
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| 92 |
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[0eb7bf3] | 93 | void QtMoleculeList::update(Observable *publisher) {
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[3eb91c] | 94 | ASSERT(0,
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| 95 | "QtMoleculeList::update() - we did not sign up for any global updates.");
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| 96 | }
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| 97 |
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| 98 | void QtMoleculeList::recieveNotification(Observable *publisher, Notification_ptr notification) {
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[a39006] | 99 |
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[41815a3] | 100 | if (selecting)
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| 101 | return;
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| 102 |
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[a39006] | 103 | dirty = true;
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| 104 | }
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| 105 |
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[3eb91c] | 106 |
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[0eb7bf3] | 107 | void QtMoleculeList::refill() {
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[6cab535] | 108 | clearing = true;
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[41815a3] | 109 | const std::vector<molecule*> &molecules = World::getInstance().getAllMolecules();
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| 110 |
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[79b59b] | 111 | clear();
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[3eb91c] | 112 | formula.clear();
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| 113 | FormulaVisibilityCountMap.clear();
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[79b59b] | 114 |
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[41815a3] | 115 | for (std::vector<molecule*>::const_iterator iter = molecules.begin();
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| 116 | iter != molecules.end();
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| 117 | iter++) {
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[b47bfc] | 118 |
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[79b59b] | 119 | // find group if already in list
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| 120 | QTreeWidgetItem *groupItem = NULL;
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[3eb91c] | 121 | const std::string &molecule_formula = (*iter)->getFormula().toString();
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| 122 | FormulaTreeItemMap_t::const_iterator formulaiter =
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| 123 | formula.find(molecule_formula);
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[79b59b] | 124 |
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| 125 | // new molecule type -> create new group
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[3eb91c] | 126 | if (formulaiter == formula.end()){
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| 127 | // insert new formula entry into visibility
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| 128 | #ifndef NDEBUG
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| 129 | std::pair< FormulaVisibilityCountMap_t::iterator, bool> visibilityinserter =
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| 130 | #endif
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| 131 | FormulaVisibilityCountMap.insert(
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| 132 | std::make_pair( molecule_formula, (unsigned int)0) );
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| 133 | ASSERT( visibilityinserter.second,
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| 134 | "QtMoleculeList::refill() - molecule with formula "
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| 135 | +molecule_formula+" already in FormulaVisibilityCountMap.");
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| 136 |
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| 137 | // create item and place into Map with formula as key
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[79b59b] | 138 | groupItem = new QTreeWidgetItem(this);
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[3eb91c] | 139 | formula.insert( std::make_pair(molecule_formula, groupItem) );
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| 140 | // fill item
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[739ee9] | 141 | groupItem->setText(NAME, QString("default"));
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[3eb91c] | 142 | groupItem->setFlags((groupItem->flags() | Qt::ItemIsUserCheckable) ^ Qt::ItemIsSelectable);
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| 143 | groupItem->setCheckState(VISIBILITY, Qt::Unchecked);
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[739ee9] | 144 | groupItem->setText(ATOMCOUNT, QString::number(0));
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| 145 | groupItem->setText(FORMULA, QString(""));
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| 146 | groupItem->setText(OCCURRENCE, "0");
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[41815a3] | 147 | groupItem->setData(0, Qt::UserRole, QVariant(-1));
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[3eb91c] | 148 | } else {
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| 149 | groupItem = formulaiter->second;
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[79b59b] | 150 | }
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| 151 |
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| 152 | // add molecule
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| 153 | QTreeWidgetItem *molItem = new QTreeWidgetItem(groupItem);
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[739ee9] | 154 | molItem->setText(NAME, QString((*iter)->getName().c_str()));
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[3eb91c] | 155 | molItem->setFlags(molItem->flags() | Qt::ItemIsUserCheckable | Qt::ItemIsSelectable);
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[739ee9] | 156 | molItem->setCheckState(VISIBILITY, Qt::Unchecked);
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| 157 | molItem->setText(ATOMCOUNT, QString::number((*iter)->getAtomCount()));
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[3eb91c] | 158 | molItem->setText(FORMULA, QString(molecule_formula.c_str()));
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[41815a3] | 159 | const int index = (*iter)->getId();
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[79b59b] | 160 | molItem->setData(0, Qt::UserRole, QVariant(index));
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[b14efe] | 161 | molItem->setSelected(World::getInstance().isSelected(*iter));
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[79b59b] | 162 |
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| 163 | // increase group occurrence
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[3eb91c] | 164 | int count = groupItem->text(OCCURRENCE).toInt() + 1;
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[739ee9] | 165 | groupItem->setText(OCCURRENCE, QString::number(count));
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[b47bfc] | 166 | }
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[a39006] | 167 | dirty = false;
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[6cab535] | 168 | clearing = false;
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[a39006] | 169 | }
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| 170 |
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[0eb7bf3] | 171 | void QtMoleculeList::paintEvent(QPaintEvent * event)
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[a39006] | 172 | {
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| 173 | if (dirty)
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| 174 | refill();
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| 175 | QTreeWidget::paintEvent(event);
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[b47bfc] | 176 | }
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| 177 |
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[0eb7bf3] | 178 | void QtMoleculeList::subjectKilled(Observable *publisher) {
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[b47bfc] | 179 | }
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| 180 |
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[739ee9] | 181 | void QtMoleculeList::visibilityChanged(QTreeWidgetItem* item, int column)
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| 182 | {
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[3eb91c] | 183 | if ((!clearing) && (!ChangingChildrensVisibility))
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| 184 | if (column == VISIBILITY) {
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| 185 | const moleculeId_t molid = item->data(0, Qt::UserRole).toInt();
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| 186 | const bool visible = item->checkState(VISIBILITY);
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| 187 | if (molid != (unsigned int)-1) { // molecule item
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| 188 | const molecule * const _molecule =
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| 189 | World::getInstance().getMolecule(MoleculeById(molid));
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| 190 | ASSERT( _molecule != NULL,
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| 191 | "QtMoleculeList::visibilityChanged() - molecule with id "
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| 192 | +toString(molid)+" is not known to World.");
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| 193 | const std::string &molecule_formula = _molecule->getFormula().toString();
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| 194 | ASSERT( FormulaVisibilityCountMap.count(molecule_formula) != 0,
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| 195 | "QtMoleculeList::visibilityChanged() - molecule with formula " +molecule_formula
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| 196 | +" is not present in FormulaVisibilityCountMap.");
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| 197 |
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| 198 | // get parent
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| 199 | QTreeWidgetItem *groupItem = item->parent();
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| 200 | ASSERT( groupItem != NULL,
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| 201 | "QtMoleculeList::visibilityChanged() - item with id "+toString(molid)
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| 202 | +" has not parent?");
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| 203 | // check whether we have to set the group item
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| 204 |
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| 205 | ChangingChildrensVisibility = true;
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| 206 | if (visible) {
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| 207 | ++(FormulaVisibilityCountMap[molecule_formula]);
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| 208 | // compare with occurence/total number of molecules
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| 209 | if (FormulaVisibilityCountMap[molecule_formula] ==
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| 210 | (unsigned int)(groupItem->text(OCCURRENCE).toInt()))
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| 211 | groupItem->setCheckState(VISIBILITY, Qt::Checked);
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| 212 | } else {
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| 213 | --(FormulaVisibilityCountMap[molecule_formula]);
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| 214 | // none selected anymore?
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| 215 | if (FormulaVisibilityCountMap[molecule_formula] == 0)
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| 216 | groupItem->setCheckState(VISIBILITY, Qt::Unchecked);
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| 217 | }
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| 218 | ChangingChildrensVisibility = false;
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| 219 |
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| 220 | emit moleculesVisibilityChanged(molid, visible);
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| 221 |
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| 222 | } else { // group item
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| 223 |
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| 224 | // go through all children, but don't enter for groupItem once more
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| 225 | ChangingChildrensVisibility = true;
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| 226 | for (int i=0;i<item->childCount();++i) {
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| 227 | QTreeWidgetItem *molItem = item->child(i);
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| 228 | const moleculeId_t molid = molItem->data(0, Qt::UserRole).toInt();
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| 229 | ASSERT( molid != (unsigned int)-1,
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| 230 | "QtMoleculeList::visibilityChanged() - to child with index"
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| 231 | +toString(i)+" there is no molecule?");
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| 232 | molItem->setCheckState(VISIBILITY, visible ? Qt::Checked : Qt::Unchecked);
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| 233 |
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| 234 | // emit signal
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| 235 | emit moleculesVisibilityChanged(molid, visible);
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| 236 | }
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| 237 | // set current number of visible children
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| 238 | const std::string molecule_formula =
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| 239 | item->text(FORMULA).toStdString();
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| 240 | FormulaVisibilityCountMap[molecule_formula] =
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| 241 | visible ? item->text(OCCURRENCE).toInt() : 0;
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| 242 |
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| 243 | ChangingChildrensVisibility = false;
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| 244 | }
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| 245 | }
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[739ee9] | 246 | }
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| 247 |
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[0eb7bf3] | 248 | void QtMoleculeList::moleculeChanged() {
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[79b59b] | 249 | /*int idx = verticalHeaderItem(row)->data(Qt::UserRole).toInt();
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[b47bfc] | 250 | molecule *mol = molecules->ReturnIndex(idx);
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| 251 | string cellValue = item(row,NAME)->text().toStdString();
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| 252 | if(mol->getName() != cellValue && cellValue !="") {
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| 253 | mol->setName(cellValue);
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| 254 | }
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| 255 | else if(cellValue==""){
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| 256 | item(row,NAME)->setText(QString(mol->getName().c_str()));
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[79b59b] | 257 | }*/
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[b47bfc] | 258 | }
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| 259 |
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[0eb7bf3] | 260 | void QtMoleculeList::rowsSelected(const QItemSelection & selected, const QItemSelection & deselected){
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[b14efe] | 261 |
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[99e8ea] | 262 | if (clearing)
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| 263 | return;
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[41815a3] | 264 | if (selecting)
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| 265 | return;
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| 266 | selecting = true;
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| 267 |
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| 268 | // Select all molecules which belong to newly selected rows.
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| 269 | QModelIndex index;
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| 270 | QModelIndexList items = selected.indexes();
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| 271 | foreach (index, items)
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| 272 | if (index.column() == 0){
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| 273 | int mol_id = model()->data(index, Qt::UserRole).toInt();
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| 274 | if (mol_id < 0)
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| 275 | continue;
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| 276 | //std::cout << "select molecule" << std::endl;
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| 277 | MoleCuilder::SelectionMoleculeById(mol_id);
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| 278 | }
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[99e8ea] | 279 |
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[41815a3] | 280 | // Unselect all molecules which belong to newly unselected rows.
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| 281 | items = deselected.indexes();
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| 282 | foreach (index, items)
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| 283 | if (index.column() == 0){
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| 284 | int mol_id = model()->data(index, Qt::UserRole).toInt();
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| 285 | if (mol_id < 0)
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| 286 | continue;
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| 287 | //std::cout << "unselect molecule" << std::endl;
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| 288 | MoleCuilder::SelectionNotMoleculeById(mol_id);
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[b47bfc] | 289 | }
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[41815a3] | 290 |
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| 291 | selecting = false;
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[b47bfc] | 292 | }
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