| [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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| [26cf178] | 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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 | 57 | const char *QtMoleculeList::COLUMNNAMES[QtMoleculeList::COLUMNCOUNT]={"Name","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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| [41815a3] | 71 |   World::getInstance().signOn(this);//, World::MoleculeInserted);
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 | 72 |   //World::getInstance().signOn(this, World::MoleculeRemoved);
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 | 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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| [a39006] | 78 |   refill();
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| [b47bfc] | 79 | 
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| [79b59b] | 80 |   //connect(this,SIGNAL(cellChanged(int,int)),this,SLOT(moleculeChanged(int,int)));
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| [41815a3] | 81 |   connect(selectionModel(),SIGNAL(selectionChanged(QItemSelection, QItemSelection)),this,SLOT(rowsSelected(QItemSelection, QItemSelection)));
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| [b47bfc] | 82 | 
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 | 83 | }
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 | 84 | 
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| [0eb7bf3] | 85 | QtMoleculeList::~QtMoleculeList()
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| [b47bfc] | 86 | {
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| [41815a3] | 87 |   World::getInstance().signOff(this);//, World::MoleculeInserted);
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 | 88 |   //World::getInstance().signOff(this, World::MoleculeRemoved);
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| [b47bfc] | 89 | }
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 | 90 | 
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| [0eb7bf3] | 91 | void QtMoleculeList::update(Observable *publisher) {
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| [a39006] | 92 | 
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| [41815a3] | 93 |   if (selecting)
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 | 94 |     return;
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 | 95 | 
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| [a39006] | 96 |   dirty = true;
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 | 97 | 
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 | 98 |   // force an update from Qt...
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| [99e8ea] | 99 |   clearing = true;
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| [a39006] | 100 |   clear();
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| [99e8ea] | 101 |   clearing = false;
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| [a39006] | 102 | }
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 | 103 | 
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| [0eb7bf3] | 104 | void QtMoleculeList::refill() {
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| [6cab535] | 105 |   clearing = true;
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| [41815a3] | 106 |   const std::vector<molecule*> &molecules = World::getInstance().getAllMolecules();
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 | 107 | 
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| [79b59b] | 108 |   clear();
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 | 109 | 
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 | 110 |   // list of (unique) formulas in the world
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 | 111 |   std::vector<Formula> formula;
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 | 112 | 
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| [41815a3] | 113 |   for (std::vector<molecule*>::const_iterator iter = molecules.begin();
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 | 114 |       iter != molecules.end();
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 | 115 |       iter++) {
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| [b47bfc] | 116 | 
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| [79b59b] | 117 |     // find group if already in list
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 | 118 |     QTreeWidgetItem *groupItem = NULL;
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 | 119 |     for (unsigned int j=0;j<formula.size();j++)
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 | 120 |       if ((*iter)->getFormula() == formula[j]){
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 | 121 |         groupItem = topLevelItem(j);
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 | 122 |         break;
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 | 123 |       }
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 | 124 | 
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 | 125 |     // new molecule type -> create new group
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 | 126 |     if (!groupItem){
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 | 127 |       formula.push_back((*iter)->getFormula());
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 | 128 |       groupItem = new QTreeWidgetItem(this);
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 | 129 |       groupItem->setText(0, QString((*iter)->getName().c_str()));
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 | 130 |       groupItem->setText(1, QString::number((*iter)->getAtomCount()));
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 | 131 |       groupItem->setText(2, QString((*iter)->getFormula().toString().c_str()));
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 | 132 |       groupItem->setText(3, "0");
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| [41815a3] | 133 |       groupItem->setData(0, Qt::UserRole, QVariant(-1));
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| [79b59b] | 134 |     }
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 | 135 | 
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 | 136 |     // add molecule
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 | 137 |     QTreeWidgetItem *molItem = new QTreeWidgetItem(groupItem);
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 | 138 |     molItem->setText(0, QString((*iter)->getName().c_str()));
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 | 139 |     molItem->setText(1, QString::number((*iter)->getAtomCount()));
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 | 140 |     molItem->setText(2, QString((*iter)->getFormula().toString().c_str()));
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| [41815a3] | 141 |     const int index = (*iter)->getId();
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| [79b59b] | 142 |     molItem->setData(0, Qt::UserRole, QVariant(index));
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| [b14efe] | 143 |     molItem->setSelected(World::getInstance().isSelected(*iter));
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| [79b59b] | 144 | 
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 | 145 | 
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 | 146 |     // increase group occurrence
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 | 147 |     int count = groupItem->text(3).toInt() + 1;
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 | 148 |     groupItem->setText(3, QString::number(count));
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| [b47bfc] | 149 |   }
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| [a39006] | 150 |   dirty = false;
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| [6cab535] | 151 |   clearing = false;
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| [a39006] | 152 | }
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 | 153 | 
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| [0eb7bf3] | 154 | void QtMoleculeList::paintEvent(QPaintEvent * event)
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| [a39006] | 155 | {
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 | 156 |   if (dirty)
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 | 157 |     refill();
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 | 158 |   QTreeWidget::paintEvent(event);
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| [b47bfc] | 159 | }
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 | 160 | 
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| [0eb7bf3] | 161 | void QtMoleculeList::subjectKilled(Observable *publisher) {
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| [b47bfc] | 162 | }
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 | 163 | 
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| [0eb7bf3] | 164 | void QtMoleculeList::moleculeChanged() {
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| [79b59b] | 165 |   /*int idx = verticalHeaderItem(row)->data(Qt::UserRole).toInt();
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| [b47bfc] | 166 |   molecule *mol = molecules->ReturnIndex(idx);
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 | 167 |   string cellValue = item(row,NAME)->text().toStdString();
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 | 168 |   if(mol->getName() != cellValue && cellValue !="") {
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 | 169 |     mol->setName(cellValue);
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 | 170 |   }
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 | 171 |   else if(cellValue==""){
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 | 172 |     item(row,NAME)->setText(QString(mol->getName().c_str()));
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| [79b59b] | 173 |   }*/
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| [b47bfc] | 174 | }
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 | 175 | 
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| [0eb7bf3] | 176 | void QtMoleculeList::rowsSelected(const QItemSelection & selected, const QItemSelection & deselected){
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| [b14efe] | 177 | 
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| [99e8ea] | 178 |   if (clearing)
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 | 179 |     return;
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| [41815a3] | 180 |   if (selecting)
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 | 181 |     return;
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 | 182 |   selecting = true;
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 | 183 | 
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 | 184 |   // Select all molecules which belong to newly selected rows.
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 | 185 |   QModelIndex index;
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 | 186 |   QModelIndexList items = selected.indexes();
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 | 187 |   foreach (index, items)
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 | 188 |     if (index.column() == 0){
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 | 189 |       int mol_id = model()->data(index, Qt::UserRole).toInt();
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 | 190 |       if (mol_id < 0)
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 | 191 |         continue;
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 | 192 |       //std::cout << "select molecule" << std::endl;
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 | 193 |       MoleCuilder::SelectionMoleculeById(mol_id);
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 | 194 |     }
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| [99e8ea] | 195 | 
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| [41815a3] | 196 |   // Unselect all molecules which belong to newly unselected rows.
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 | 197 |   items = deselected.indexes();
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 | 198 |   foreach (index, items)
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 | 199 |     if (index.column() == 0){
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 | 200 |       int mol_id = model()->data(index, Qt::UserRole).toInt();
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 | 201 |       if (mol_id < 0)
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 | 202 |         continue;
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 | 203 |       //std::cout << "unselect molecule" << std::endl;
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 | 204 |       MoleCuilder::SelectionNotMoleculeById(mol_id);
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| [b47bfc] | 205 |     }
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| [41815a3] | 206 | 
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 | 207 |   selecting = false;
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| [b47bfc] | 208 | }
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