public void UseCurrentData()
{
DPRegressionData regressionData = GetRegressionData();
if (regressionData == null)
{
return;
}
var regressionLine = regressionData.RegressionLine;
if (regressionLine == null)
{
MessageDlg.Show(this, Resources.EditDPDlg_UseCurrentData_Insufficient_data_found_to_calculate_a_new_regression);
return;
}
textSlope.Text = string.Format(@"{0:F04}", regressionLine.Slope);
textIntercept.Text = string.Format(@"{0:F04}", regressionLine.Intercept);
}
private DPRegressionData GetRegressionData()
{
var document = Program.ActiveDocumentUI;
if (!document.Settings.HasResults)
{
return(null);
}
if (!document.Settings.MeasuredResults.IsLoaded)
{
MessageBox.Show(this, Resources.EditDPDlg_GetRegressionData_Measured_results_must_be_completely_loaded_before_they_can_be_used_to_create_a_declustering_potential_regression,
Program.Name);
return(null);
}
var regressionCurrent = _regression ??
document.Settings.TransitionSettings.Prediction.DeclusteringPotential;
var regressionData = new DPRegressionData(regressionCurrent != null ?
regressionCurrent.RegressionLine : null);
var chromatograms = document.Settings.MeasuredResults.Chromatograms;
for (int i = 0; i < chromatograms.Count; i++)
{
var chromSet = chromatograms[i];
var regression = chromSet.OptimizationFunction as DeclusteringPotentialRegression;
if (regression == null)
{
continue;
}
foreach (var nodeGroup in document.MoleculeTransitionGroups)
{
regressionData.Add(regression, nodeGroup, i);
}
}
return(regressionData);
}
public void ShowGraph()
{
DPRegressionData regressionData = GetRegressionData();
if (regressionData == null)
{
return;
}
var graphData = new RegressionGraphData
{
Title = Resources.EditDPDlg_ShowGraph_Declustering_Potential_Regression,
LabelX = Resources.EditDPDlg_ShowGraph_Precursor_m_z,
LabelY = Resources.EditDPDlg_ShowGraph_Declustering_Potential,
XValues = regressionData.PrecursorMzValues,
YValues = regressionData.BestValues,
RegressionLine = regressionData.RegressionLine,
RegressionLineCurrent = regressionData.RegressionLineSetting
};
using (var dlg = new GraphRegression(new[] { graphData }))
{
dlg.ShowDialog(this);
}
}
