source: src/UIElements/Views/Qt4/QtMoleculeList.cpp@ afd3d2

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Last change on this file since afd3d2 was 94d5ac6, checked in by Frederik Heber <heber@…>, 12 years ago

FIX: As we use GSL internally, we are as of now required to use GPL v2 license.

  • GNU Scientific Library is used at every place in the code, especially the sub-package LinearAlgebra is based on it which in turn is used really everywhere in the remainder of MoleCuilder. Hence, we have to use the GPL license for the whole of MoleCuilder. In effect, GPL's COPYING was present all along and stated the terms of the GPL v2 license.
  • Hence, I added the default GPL v2 disclaimer to every source file and removed the note about a (actually missing) LICENSE file.
  • also, I added a help-redistribute action which again gives the disclaimer of the GPL v2.
  • also, I changed in the disclaimer that is printed at every program start in builder_init.cpp.
  • TEST: Added check on GPL statement present in every module to test CodeChecks project-disclaimer.
  • Property mode set to 100644
File size: 5.9 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 * QtMoleculeList.cpp
25 *
26 * Created on: Jan 21, 2010
27 * Author: crueger
28 */
29
30// include config.h
31#ifdef HAVE_CONFIG_H
32#include <config.h>
33#endif
34
35#include "Views/Qt4/QtMoleculeList.hpp"
36
37#include <QMetaMethod>
38
39#include <iostream>
40
41#include "CodePatterns/MemDebug.hpp"
42
43#include "Atom/atom.hpp"
44#include "Formula.hpp"
45#include "molecule.hpp"
46#include "MoleculeListClass.hpp"
47#include "Actions/SelectionAction/Molecules/MoleculeByIdAction.hpp"
48#include "Actions/SelectionAction/Molecules/NotMoleculeByIdAction.hpp"
49
50using namespace std;
51
52// maybe this should go with the definition of molecules
53
54// some attributes need to be easier to find for molecules
55// these attributes are skipped so far
56const int QtMoleculeList::COLUMNCOUNT = COLUMNTYPES_MAX;
57const char *QtMoleculeList::COLUMNNAMES[QtMoleculeList::COLUMNCOUNT]={"Name","Atoms","Formula","Occurrence"/*,"Size"*/};
58
59QtMoleculeList::QtMoleculeList(QWidget * _parent) :
60 QTreeWidget (_parent),
61 Observer("QtMoleculeList")
62{
63 setColumnCount(COLUMNCOUNT);
64 setSelectionMode(QAbstractItemView::MultiSelection);
65
66 QStringList header;
67 for(int i=0; i<COLUMNCOUNT;++i)
68 header << COLUMNNAMES[i];
69 setHeaderLabels(header);
70
71 World::getInstance().signOn(this);//, World::MoleculeInserted);
72 //World::getInstance().signOn(this, World::MoleculeRemoved);
73
74
75 dirty = true;
76 clearing = false;
77 selecting = false;
78 refill();
79
80 //connect(this,SIGNAL(cellChanged(int,int)),this,SLOT(moleculeChanged(int,int)));
81 connect(selectionModel(),SIGNAL(selectionChanged(QItemSelection, QItemSelection)),this,SLOT(rowsSelected(QItemSelection, QItemSelection)));
82
83}
84
85QtMoleculeList::~QtMoleculeList()
86{
87 World::getInstance().signOff(this);//, World::MoleculeInserted);
88 //World::getInstance().signOff(this, World::MoleculeRemoved);
89}
90
91void QtMoleculeList::update(Observable *publisher) {
92
93 if (selecting)
94 return;
95
96 dirty = true;
97
98 // force an update from Qt...
99 clearing = true;
100 clear();
101 clearing = false;
102}
103
104void QtMoleculeList::refill() {
105 clearing = true;
106 const std::vector<molecule*> &molecules = World::getInstance().getAllMolecules();
107
108 clear();
109
110 // list of (unique) formulas in the world
111 std::vector<Formula> formula;
112
113 for (std::vector<molecule*>::const_iterator iter = molecules.begin();
114 iter != molecules.end();
115 iter++) {
116
117 // find group if already in list
118 QTreeWidgetItem *groupItem = NULL;
119 for (unsigned int j=0;j<formula.size();j++)
120 if ((*iter)->getFormula() == formula[j]){
121 groupItem = topLevelItem(j);
122 break;
123 }
124
125 // new molecule type -> create new group
126 if (!groupItem){
127 formula.push_back((*iter)->getFormula());
128 groupItem = new QTreeWidgetItem(this);
129 groupItem->setText(0, QString((*iter)->getName().c_str()));
130 groupItem->setText(1, QString::number((*iter)->getAtomCount()));
131 groupItem->setText(2, QString((*iter)->getFormula().toString().c_str()));
132 groupItem->setText(3, "0");
133 groupItem->setData(0, Qt::UserRole, QVariant(-1));
134 }
135
136 // add molecule
137 QTreeWidgetItem *molItem = new QTreeWidgetItem(groupItem);
138 molItem->setText(0, QString((*iter)->getName().c_str()));
139 molItem->setText(1, QString::number((*iter)->getAtomCount()));
140 molItem->setText(2, QString((*iter)->getFormula().toString().c_str()));
141 const int index = (*iter)->getId();
142 molItem->setData(0, Qt::UserRole, QVariant(index));
143 molItem->setSelected(World::getInstance().isSelected(*iter));
144
145
146 // increase group occurrence
147 int count = groupItem->text(3).toInt() + 1;
148 groupItem->setText(3, QString::number(count));
149 }
150 dirty = false;
151 clearing = false;
152}
153
154void QtMoleculeList::paintEvent(QPaintEvent * event)
155{
156 if (dirty)
157 refill();
158 QTreeWidget::paintEvent(event);
159}
160
161void QtMoleculeList::subjectKilled(Observable *publisher) {
162}
163
164void QtMoleculeList::moleculeChanged() {
165 /*int idx = verticalHeaderItem(row)->data(Qt::UserRole).toInt();
166 molecule *mol = molecules->ReturnIndex(idx);
167 string cellValue = item(row,NAME)->text().toStdString();
168 if(mol->getName() != cellValue && cellValue !="") {
169 mol->setName(cellValue);
170 }
171 else if(cellValue==""){
172 item(row,NAME)->setText(QString(mol->getName().c_str()));
173 }*/
174}
175
176void QtMoleculeList::rowsSelected(const QItemSelection & selected, const QItemSelection & deselected){
177
178 if (clearing)
179 return;
180 if (selecting)
181 return;
182 selecting = true;
183
184 // Select all molecules which belong to newly selected rows.
185 QModelIndex index;
186 QModelIndexList items = selected.indexes();
187 foreach (index, items)
188 if (index.column() == 0){
189 int mol_id = model()->data(index, Qt::UserRole).toInt();
190 if (mol_id < 0)
191 continue;
192 //std::cout << "select molecule" << std::endl;
193 MoleCuilder::SelectionMoleculeById(mol_id);
194 }
195
196 // Unselect all molecules which belong to newly unselected rows.
197 items = deselected.indexes();
198 foreach (index, items)
199 if (index.column() == 0){
200 int mol_id = model()->data(index, Qt::UserRole).toInt();
201 if (mol_id < 0)
202 continue;
203 //std::cout << "unselect molecule" << std::endl;
204 MoleCuilder::SelectionNotMoleculeById(mol_id);
205 }
206
207 selecting = false;
208}
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