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Commit 9060c2b5 authored by Langella Olivier's avatar Langella Olivier
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beautifull mass delta histogram

parent fb96af01
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......@@ -24,7 +24,7 @@
<string/>
</property>
<property name="currentIndex">
<number>0</number>
<number>3</number>
</property>
<widget class="QWidget" name="identifications">
<attribute name="title">
......@@ -270,73 +270,92 @@
<item row="0" column="0">
<layout class="QVBoxLayout" name="verticalLayout_5">
<item>
<layout class="QFormLayout" name="formLayout_2">
<item row="0" column="0">
<layout class="QFormLayout" name="formLayout_3"/>
</item>
<item row="0" column="1">
<widget class="QComboBox" name="precision_unit_combobox">
<item>
<property name="text">
<string>ppm</string>
</property>
</item>
<item>
<property name="text">
<string>dalton</string>
<widget class="QWidget" name="widget" native="true">
<property name="sizePolicy">
<sizepolicy hsizetype="Preferred" vsizetype="Fixed">
<horstretch>0</horstretch>
<verstretch>0</verstretch>
</sizepolicy>
</property>
<layout class="QVBoxLayout" name="verticalLayout_7">
<item>
<layout class="QFormLayout" name="formLayout_2">
<property name="sizeConstraint">
<enum>QLayout::SetMinimumSize</enum>
</property>
</item>
</widget>
</item>
<item row="1" column="0">
<widget class="QLabel" name="label_2">
<property name="text">
<string>mean</string>
</property>
</widget>
</item>
<item row="1" column="1">
<widget class="QLabel" name="mass_precision_mean_label">
<property name="text">
<string>0</string>
</property>
</widget>
</item>
<item row="2" column="0">
<widget class="QLabel" name="label_4">
<property name="text">
<string>median</string>
</property>
</widget>
</item>
<item row="2" column="1">
<widget class="QLabel" name="mass_precision_median_label">
<property name="text">
<string>0</string>
</property>
</widget>
</item>
<item row="3" column="0">
<widget class="QLabel" name="label_5">
<property name="text">
<string>standard deviation</string>
</property>
</widget>
</item>
<item row="3" column="1">
<widget class="QLabel" name="mass_precision_sd_label">
<property name="toolTip">
<string>Mass deviation is computed on all valid and checked proteins but not decoy</string>
</property>
<property name="text">
<string>0</string>
</property>
</widget>
</item>
</layout>
<item row="0" column="1">
<widget class="QComboBox" name="precision_unit_combobox">
<item>
<property name="text">
<string>ppm</string>
</property>
</item>
<item>
<property name="text">
<string>dalton</string>
</property>
</item>
</widget>
</item>
<item row="1" column="0">
<widget class="QLabel" name="label_2">
<property name="text">
<string>mean</string>
</property>
</widget>
</item>
<item row="1" column="1">
<widget class="QLabel" name="mass_precision_mean_label">
<property name="text">
<string>0</string>
</property>
</widget>
</item>
<item row="2" column="0">
<widget class="QLabel" name="label_4">
<property name="text">
<string>median</string>
</property>
</widget>
</item>
<item row="2" column="1">
<widget class="QLabel" name="mass_precision_median_label">
<property name="text">
<string>0</string>
</property>
</widget>
</item>
<item row="3" column="0">
<widget class="QLabel" name="label_5">
<property name="text">
<string>standard deviation</string>
</property>
</widget>
</item>
<item row="3" column="1">
<widget class="QLabel" name="mass_precision_sd_label">
<property name="toolTip">
<string>Mass deviation is computed on all valid and checked proteins but not decoy</string>
</property>
<property name="text">
<string>0</string>
</property>
</widget>
</item>
</layout>
</item>
</layout>
</widget>
</item>
<item>
<widget class="QCustomPlot" name="mass_histogram_widget" native="true"/>
<widget class="QCustomPlot" name="mass_histogram_widget" native="true">
<property name="sizePolicy">
<sizepolicy hsizetype="Preferred" vsizetype="Expanding">
<horstretch>0</horstretch>
<verstretch>0</verstretch>
</sizepolicy>
</property>
</widget>
</item>
</layout>
</item>
......
......@@ -67,6 +67,26 @@ ProjectWindow::ProjectWindow(MainWindow *parent):
_p_waiting_message_dialog = new WaitingMessageDialog(this);
ui->mass_histogram_widget->xAxis->setLabel("mass delta");
ui->mass_histogram_widget->yAxis->setLabel("count");
ui->mass_histogram_widget->setInteractions(QCP::iRangeDrag | QCP::iRangeZoom );
ui->mass_histogram_widget->axisRects().at(0)->setRangeDrag(Qt::Horizontal);
ui->mass_histogram_widget->axisRects().at(0)->setRangeZoom(Qt::Horizontal);
//legend->setVisible(false);
ui->mass_histogram_widget->legend->setFont(QFont("Helvetica",9));
// set locale to english, so we get english decimal separator:
//setLocale(QLocale(QLocale::English, QLocale::UnitedKingdom));
setFocusPolicy(Qt::ClickFocus);
QCPGraph * p_graph = ui->mass_histogram_widget->addGraph();
//p_graph->setName("raw xic");
//QPen pen;
//pen.setColor(getNewColors());
//graph()->setPen(pen);
//graph()->setName(lineNames.at(i-QCPGraph::lsNone));
p_graph->setLineStyle(QCPGraph::LineStyle::lsStepCenter);
//p_graph->setScatterStyle(QCPScatterStyle(QCPScatterStyle::ssDisc, 2.0));
#if QT_VERSION >= 0x050000
// Qt5 code
......@@ -294,14 +314,7 @@ void ProjectWindow::computeMassPrecision() {
y.push_back(mass_pair.second);
}
QCPGraph * p_graph = ui->mass_histogram_widget->addGraph();
//p_graph->setName("raw xic");
//QPen pen;
//pen.setColor(getNewColors());
//graph()->setPen(pen);
//graph()->setName(lineNames.at(i-QCPGraph::lsNone));
p_graph->setLineStyle(QCPGraph::LineStyle::lsStepCenter);
//p_graph->setScatterStyle(QCPScatterStyle(QCPScatterStyle::ssDisc, 2.0));
QCPGraph * p_graph = ui->mass_histogram_widget->graph();
p_graph->setData(x,y);
p_graph->rescaleAxes(true);
ui->mass_histogram_widget->rescaleAxes();
......
......@@ -39,7 +39,7 @@ const QString Utils::getDatabaseName(ExternalDatabase database) {
std::vector<std::pair<pappso::pappso_double, size_t>> Utils::getHistogram(std::vector<pappso::pappso_double> data_values, unsigned int number_of_class) {
std::vector<std::pair<pappso::pappso_double, size_t>> histogram(number_of_class);
std::vector<std::pair<pappso::pappso_double, size_t>> histogram(number_of_class+1);
try {
qDebug() << "Utils::getHistogram begin";
......@@ -51,11 +51,12 @@ std::vector<std::pair<pappso::pappso_double, size_t>> Utils::getHistogram(std::v
qDebug() << "Utils::getHistogram number_of_class offset=" << offset;
for (unsigned int i= 0; i < histogram.size(); i++) {
histogram[i] = std::pair<pappso::pappso_double, size_t> {(min + (offset * i) + (offset/2)), 0};
qDebug() << "Utils::getHistogram x=" << histogram[i].first;
}
qDebug() << "Utils::getHistogram data_values";
for (pappso::pappso_double value :data_values) {
qDebug() << "Utils::getHistogram value=" << value;
unsigned int i = std::abs((min+(min-value))/offset );
//qDebug() << "Utils::getHistogram value=" << value;
unsigned int i = std::abs((value-min)/offset );
qDebug() << "Utils::getHistogram i=" << i << " size=" << histogram.size();
histogram.at(i).second++;
}
......
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