Beispiel #1
0
        /// <summary>
        /// Perform the visual changes in the Filter tab depending on which acquisition method is selected in the FullScan tab
        /// - hides the precursor exclusion field and shows the exclusion DIA checkbox for DIA methods
        /// - shows the precursor exclusion field and hides the exclusion DIA checkbox for other methods
        /// </summary>
        private void DoIsolationSchemeChanged()
        {
            if (FullScanSettingsControl.IsDIA())
            {
                // VISUAL - Show GUI elements relevant to DIA
                cbExclusionUseDIAWindow.Visible = true;
                textExclusionWindow.Visible     = false;
                lbMZ.Visible = false;
                lbPrecursorMzWindow.Visible = false;

                // VISUAL - Move the lower boundary of the box and the cbAutoSelect up
                int oldLowerMargin = groupBox1.Height - cbExclusionUseDIAWindow.Location.Y - cbExclusionUseDIAWindow.Height;
                int pixelShift     = oldLowerMargin - _lower_margin;
                cbAutoSelect.Location = new Point(cbAutoSelect.Location.X, cbAutoSelect.Location.Y - pixelShift);
                groupBox1.Size        = new Size(groupBox1.Size.Width, groupBox1.Size.Height - pixelShift);

                textExclusionWindow.Text = string.Empty; // reset data field
            }
            else
            {
                // VISUAL - Show GUI elements relevant to non-DIA methods or DIA methods not from results
                cbExclusionUseDIAWindow.Visible = false;
                textExclusionWindow.Visible     = true;
                lbMZ.Visible = true;
                lbPrecursorMzWindow.Visible = true;

                // VISUAL - Move the lower boundary of the box and the cbAutoSelect down
                int oldLowerMargin = groupBox1.Height - textExclusionWindow.Location.Y - textExclusionWindow.Height;
                int pixelShift     = oldLowerMargin - _lower_margin;
                cbAutoSelect.Location = new Point(cbAutoSelect.Location.X, cbAutoSelect.Location.Y - pixelShift);
                groupBox1.Size        = new Size(groupBox1.Size.Width, groupBox1.Size.Height - pixelShift);

                cbExclusionUseDIAWindow.Checked = false; // reset data field
            }
        }
Beispiel #2
0
 /// <summary>
 /// Callback function which gets called when the user changes the isolation scheme in the full scan tab
 /// Note: this function should only be called iff the user manually changed the Isolation Scheme
 /// </summary>
 private void IsolationSchemeChanged(object sender, EventArgs e)
 {
     DoIsolationSchemeChanged();
     // Setting default value (true) for ExclusionUseDIAWindow if the setting was changed
     // and if preselected windows are enabled
     // (but not if the user simply loaded settings)
     cbExclusionUseDIAWindow.Checked = FullScanSettingsControl.IsDIAAndPreselectedWindows();
 }
        public ImportPeptideSearchDlg(SkylineWindow skylineWindow, LibraryManager libraryManager)
        {
            SkylineWindow = skylineWindow;
            ImportPeptideSearch = new ImportPeptideSearch();

            InitializeComponent();

            Icon = Resources.Skyline;

            CurrentPage = Pages.spectra_page;
            btnNext.Text = Resources.ImportPeptideSearchDlg_ImportPeptideSearchDlg_Next;
            AcceptButton = btnNext;
            btnNext.Enabled = HasUnmatchedLibraryRuns(SkylineWindow.DocumentUI);

            // Create and add wizard pages
            BuildPepSearchLibControl = new BuildPeptideSearchLibraryControl(SkylineWindow, ImportPeptideSearch, libraryManager)
            {
                Anchor = (AnchorStyles.Top | AnchorStyles.Bottom | AnchorStyles.Left | AnchorStyles.Right),
                Location = new Point(2, 50)
            };
            BuildPepSearchLibControl.InputFilesChanged += BuildPepSearchLibForm_OnInputFilesChanged;
            buildSearchSpecLibPage.Controls.Add(BuildPepSearchLibControl);

            ImportFastaControl = new ImportFastaControl(SkylineWindow)
            {
                Anchor = (AnchorStyles.Top | AnchorStyles.Bottom | AnchorStyles.Left | AnchorStyles.Right),
                Location = new Point(2, 60)
            };
            importFastaPage.Controls.Add(ImportFastaControl);

            MatchModificationsControl = new MatchModificationsControl(SkylineWindow, ImportPeptideSearch)
            {
                Anchor = (AnchorStyles.Top | AnchorStyles.Bottom | AnchorStyles.Left | AnchorStyles.Right),
                Location = new Point(2, 60)
            };
            matchModificationsPage.Controls.Add(MatchModificationsControl);

            TransitionSettingsControl = new TransitionSettingsControl(SkylineWindow)
            {
                Anchor = (AnchorStyles.Top | AnchorStyles.Bottom | AnchorStyles.Left | AnchorStyles.Right),
                Location = new Point(18, 60)
            };
            transitionSettingsUiPage.Controls.Add(TransitionSettingsControl);

            FullScanSettingsControl = new FullScanSettingsControl(SkylineWindow)
            {
                Anchor = (AnchorStyles.Top | AnchorStyles.Bottom | AnchorStyles.Left | AnchorStyles.Right),
                Location = new Point(18, 50)
            };
            ms1FullScanSettingsPage.Controls.Add(FullScanSettingsControl);

            ImportResultsControl = new ImportResultsControl(ImportPeptideSearch, SkylineWindow.DocumentFilePath)
            {
                Anchor = (AnchorStyles.Top | AnchorStyles.Bottom | AnchorStyles.Left | AnchorStyles.Right),
                Location = new Point(2, 60)
            };
            getChromatogramsPage.Controls.Add((Control) ImportResultsControl);

            _pagesToSkip = new HashSet<Pages>();
        }
Beispiel #4
0
 public void AddToEnrichmentsList()
 {
     FullScanSettingsControl.AddToEnrichmentsList();
 }
Beispiel #5
0
 public void EditEnrichmentsList()
 {
     FullScanSettingsControl.EditEnrichmentsList();
 }
Beispiel #6
0
 public void SetRetentionTimeFilter(RetentionTimeFilterType retentionTimeFilterType, double length)
 {
     FullScanSettingsControl.SetRetentionTimeFilter(retentionTimeFilterType, length);
 }
Beispiel #7
0
        public TransitionSettingsUI(SkylineWindow parent)
        {
            InitializeComponent();

            // Populate the fragment finder combo boxes
            foreach (string item in TransitionFilter.GetStartFragmentFinderLabels())
            {
                comboRangeFrom.Items.Add(item);
            }
            foreach (string item in TransitionFilter.GetEndFragmentFinderLabels())
            {
                comboRangeTo.Items.Add(item);
            }

            _parent             = parent;
            _transitionSettings = _parent.DocumentUI.Settings.TransitionSettings;

            // Initialize prediction settings
            comboPrecursorMass.SelectedItem = Prediction.PrecursorMassType.GetLocalizedString();
            comboIonMass.SelectedItem       = Prediction.FragmentMassType.GetLocalizedString();

            _driverCE = new SettingsListComboDriver <CollisionEnergyRegression>(comboCollisionEnergy,
                                                                                Settings.Default.CollisionEnergyList);
            string sel = (Prediction.CollisionEnergy == null ? null : Prediction.CollisionEnergy.Name);

            _driverCE.LoadList(sel);

            _driverDP = new SettingsListComboDriver <DeclusteringPotentialRegression>(comboDeclusterPotential,
                                                                                      Settings.Default.DeclusterPotentialList);
            sel = (Prediction.DeclusteringPotential == null ? null : Prediction.DeclusteringPotential.Name);
            _driverDP.LoadList(sel);

            _driverCoV = new SettingsListComboDriver <CompensationVoltageParameters>(comboCompensationVoltage,
                                                                                     Settings.Default.CompensationVoltageList);
            _driverCoV.LoadList(Prediction.CompensationVoltage == null ? null : Prediction.CompensationVoltage.Name);

            _driverOptimizationLibrary = new SettingsListComboDriver <OptimizationLibrary>(comboOptimizationLibrary,
                                                                                           Settings.Default.OptimizationLibraryList);
            _driverOptimizationLibrary.LoadList(Prediction.OptimizedLibrary == null ? null : Prediction.OptimizedLibrary.Name);

            if (Prediction.OptimizedMethodType == OptimizedMethodType.None)
            {
                comboOptimizeType.SelectedIndex = 0;
            }
            else
            {
                cbUseOptimized.Checked         = true;
                comboOptimizeType.SelectedItem = Prediction.OptimizedMethodType.GetLocalizedString();
            }

            // Initialize filter settings
            textPrecursorCharges.Text   = Filter.PrecursorCharges.ToArray().ToString(", "); // Not L10N? Internationalization of comma?
            textIonCharges.Text         = Filter.ProductCharges.ToArray().ToString(", ");   // Not L10N? Internationalization of comma?
            textIonTypes.Text           = TransitionFilter.ToStringIonTypes(Filter.IonTypes, true);
            comboRangeFrom.SelectedItem = Filter.FragmentRangeFirst.Label;
            comboRangeTo.SelectedItem   = Filter.FragmentRangeLast.Label;
            textExclusionWindow.Text    = Filter.PrecursorMzWindow != 0
                                           ? Filter.PrecursorMzWindow.ToString(LocalizationHelper.CurrentCulture)
                                           : string.Empty;
            cbExclusionUseDIAWindow.Checked = Filter.ExclusionUseDIAWindow;
            cbAutoSelect.Checked            = Filter.AutoSelect;

            _driverIons = new MeasuredIonListBoxDriver(listAlwaysAdd, Settings.Default.MeasuredIonList);
            _driverIons.LoadList(Filter.MeasuredIons);

            // Initialize library settings
            cbLibraryPick.Checked = (Libraries.Pick != TransitionLibraryPick.none);
            panelPick.Visible     = cbLibraryPick.Checked;
            textTolerance.Text    = Libraries.IonMatchTolerance.ToString(LocalizationHelper.CurrentCulture);
            textIonCount.Text     = Libraries.IonCount.ToString(LocalizationHelper.CurrentCulture);
            if (Libraries.Pick == TransitionLibraryPick.filter)
            {
                radioFiltered.Checked = true;
            }
            else if (Libraries.Pick == TransitionLibraryPick.all_plus)
            {
                radioAllAndFiltered.Checked = true;
            }

            // Initialize instrument settings
            textMinMz.Text            = Instrument.MinMz.ToString(LocalizationHelper.CurrentCulture);
            textMaxMz.Text            = Instrument.MaxMz.ToString(LocalizationHelper.CurrentCulture);
            cbDynamicMinimum.Checked  = Instrument.IsDynamicMin;
            textMzMatchTolerance.Text = Instrument.MzMatchTolerance.ToString(LocalizationHelper.CurrentCulture);
            if (Instrument.MaxTransitions.HasValue)
            {
                textMaxTrans.Text = Instrument.MaxTransitions.Value.ToString(LocalizationHelper.CurrentCulture);
            }
            if (Instrument.MaxInclusions.HasValue)
            {
                textMaxInclusions.Text = Instrument.MaxInclusions.Value.ToString(LocalizationHelper.CurrentCulture);
            }
            if (Instrument.MinTime.HasValue)
            {
                textMinTime.Text = Instrument.MinTime.Value.ToString(LocalizationHelper.CurrentCulture);
            }
            if (Instrument.MaxTime.HasValue)
            {
                textMaxTime.Text = Instrument.MaxTime.Value.ToString(LocalizationHelper.CurrentCulture);
            }

            // Initialize full-scan settings
            FullScanSettingsControl = new FullScanSettingsControl(_parent)
            {
                Anchor   = (AnchorStyles.Top | AnchorStyles.Left),
                Location = new Point(0, 0),
                Size     = new Size(363, 491)
            };
            FullScanSettingsControl.IsolationSchemeChangedEvent += IsolationSchemeChanged;
            tabFullScan.Controls.Add(FullScanSettingsControl);

            // VISUAL:
            // - Store the distance between the cbExclusionDIAWindow and the lower end of the box (to use as margin later)
            // - Shift the cbExclusionDIAWindow down (it is only higher in the designer for better manipulation)
            _lower_margin = groupBox1.Height - textExclusionWindow.Location.Y - textExclusionWindow.Height;
            int pixelShift = cbExclusionUseDIAWindow.Location.Y - lbPrecursorMzWindow.Location.Y;

            cbExclusionUseDIAWindow.Location = new Point(cbExclusionUseDIAWindow.Location.X, cbExclusionUseDIAWindow.Location.Y - pixelShift);

            DoIsolationSchemeChanged();
        }
Beispiel #8
0
        public void OkDialog()
        {
            var helper = new MessageBoxHelper(this);

            // Validate and store prediction settings
            string   massType          = comboPrecursorMass.SelectedItem.ToString();
            MassType precursorMassType = MassTypeExtension.GetEnum(massType);

            massType = comboIonMass.SelectedItem.ToString();
            MassType fragmentMassType = MassTypeExtension.GetEnum(massType);
            string   nameCE           = comboCollisionEnergy.SelectedItem.ToString();
            CollisionEnergyRegression collisionEnergy =
                Settings.Default.GetCollisionEnergyByName(nameCE);
            string nameDP = comboDeclusterPotential.SelectedItem.ToString();
            DeclusteringPotentialRegression declusteringPotential =
                Settings.Default.GetDeclusterPotentialByName(nameDP);
            string nameCoV = comboCompensationVoltage.SelectedItem.ToString();
            CompensationVoltageParameters compensationVoltage =
                Settings.Default.GetCompensationVoltageByName(nameCoV);
            string nameOptLib = comboOptimizationLibrary.SelectedItem.ToString();
            OptimizationLibrary optimizationLibrary =
                Settings.Default.GetOptimizationLibraryByName(nameOptLib);
            OptimizedMethodType optimizedMethodType = OptimizedMethodType.None;

            if (cbUseOptimized.Checked)
            {
                optimizedMethodType = OptimizedMethodTypeExtension.GetEnum(comboOptimizeType.SelectedItem.ToString());
            }
            TransitionPrediction prediction = new TransitionPrediction(precursorMassType,
                                                                       fragmentMassType, collisionEnergy,
                                                                       declusteringPotential,
                                                                       compensationVoltage,
                                                                       optimizationLibrary,
                                                                       optimizedMethodType);

            Helpers.AssignIfEquals(ref prediction, Prediction);

            // Validate and store filter settings
            int[] precursorCharges;
            int   min = TransitionGroup.MIN_PRECURSOR_CHARGE;
            int   max = TransitionGroup.MAX_PRECURSOR_CHARGE;

            if (!helper.ValidateNumberListTextBox(tabControl1, (int)TABS.Filter, textPrecursorCharges,
                                                  min, max, out precursorCharges))
            {
                return;
            }
            precursorCharges = precursorCharges.Distinct().ToArray();

            int[] productCharges;
            min = Transition.MIN_PRODUCT_CHARGE;
            max = Transition.MAX_PRODUCT_CHARGE;
            if (!helper.ValidateNumberListTextBox(tabControl1, (int)TABS.Filter, textIonCharges,
                                                  min, max, out productCharges))
            {
                return;
            }
            productCharges = productCharges.Distinct().ToArray();

            IonType[] types = TransitionFilter.ParseTypes(textIonTypes.Text, new IonType[0]);
            if (types.Length == 0)
            {
                helper.ShowTextBoxError(tabControl1, (int)TABS.Filter, textIonTypes,
                                        Resources.TransitionSettingsUI_OkDialog_Ion_types_must_contain_a_comma_separated_list_of_ion_types_a_b_c_x_y_z_and_p_for_precursor);
                return;
            }
            types = types.Distinct().ToArray();

            double exclusionWindow = 0;

            if (!string.IsNullOrEmpty(textExclusionWindow.Text) &&
                !Equals(textExclusionWindow.Text, exclusionWindow.ToString(LocalizationHelper.CurrentCulture)))
            {
                if (!helper.ValidateDecimalTextBox(tabControl1, (int)TABS.Filter, textExclusionWindow,
                                                   TransitionFilter.MIN_EXCLUSION_WINDOW, TransitionFilter.MAX_EXCLUSION_WINDOW, out exclusionWindow))
                {
                    return;
                }
            }

            string fragmentRangeFirst = TransitionFilter.GetStartFragmentNameFromLabel(comboRangeFrom.SelectedItem.ToString());
            string fragmentRangeLast  = TransitionFilter.GetEndFragmentNameFromLabel(comboRangeTo.SelectedItem.ToString());

            var  measuredIons          = _driverIons.Chosen;
            bool autoSelect            = cbAutoSelect.Checked;
            bool exclusionUseDIAWindow = FullScanSettingsControl.IsDIA() && cbExclusionUseDIAWindow.Checked;
            var  filter = new TransitionFilter(precursorCharges, productCharges, types,
                                               fragmentRangeFirst, fragmentRangeLast, measuredIons,
                                               exclusionWindow, exclusionUseDIAWindow, autoSelect);

            Helpers.AssignIfEquals(ref filter, Filter);

            // Validate and store library settings
            TransitionLibraryPick pick = TransitionLibraryPick.none;

            if (cbLibraryPick.Checked)
            {
                if (radioAll.Checked)
                {
                    pick = TransitionLibraryPick.all;
                }
                else if (radioAllAndFiltered.Checked)
                {
                    pick = TransitionLibraryPick.all_plus;
                }
                else
                {
                    pick = TransitionLibraryPick.filter;
                }
            }

            double ionMatchTolerance;

            double minTol = TransitionLibraries.MIN_MATCH_TOLERANCE;
            double maxTol = TransitionLibraries.MAX_MATCH_TOLERANCE;

            if (!helper.ValidateDecimalTextBox(tabControl1, (int)TABS.Library, textTolerance,
                                               minTol, maxTol, out ionMatchTolerance))
            {
                return;
            }

            int ionCount = Libraries.IonCount;

            if (pick != TransitionLibraryPick.none)
            {
                min = TransitionLibraries.MIN_ION_COUNT;
                max = TransitionLibraries.MAX_ION_COUNT;
                if (!helper.ValidateNumberTextBox(tabControl1, (int)TABS.Library, textIonCount,
                                                  min, max, out ionCount))
                {
                    return;
                }
            }

            TransitionLibraries libraries = new TransitionLibraries(ionMatchTolerance, ionCount, pick);

            Helpers.AssignIfEquals(ref libraries, Libraries);

            // This dialog does not yet change integration settings
            TransitionIntegration integration = _transitionSettings.Integration;

            // Validate and store instrument settings
            int minMz;

            min = TransitionInstrument.MIN_MEASUREABLE_MZ;
            max = TransitionInstrument.MAX_MEASURABLE_MZ - TransitionInstrument.MIN_MZ_RANGE;
            if (!helper.ValidateNumberTextBox(tabControl1, (int)TABS.Instrument, textMinMz, min, max, out minMz))
            {
                return;
            }
            int maxMz;

            min = minMz + TransitionInstrument.MIN_MZ_RANGE;
            max = TransitionInstrument.MAX_MEASURABLE_MZ;
            if (!helper.ValidateNumberTextBox(tabControl1, (int)TABS.Instrument, textMaxMz, min, max, out maxMz))
            {
                return;
            }
            bool   isDynamicMin = cbDynamicMinimum.Checked;
            double mzMatchTolerance;

            minTol = TransitionInstrument.MIN_MZ_MATCH_TOLERANCE;
            maxTol = TransitionInstrument.MAX_MZ_MATCH_TOLERANCE;
            if (!helper.ValidateDecimalTextBox(tabControl1, (int)TABS.Instrument, textMzMatchTolerance,
                                               minTol, maxTol, out mzMatchTolerance))
            {
                return;
            }
            int?maxTrans = null;

            if (!string.IsNullOrEmpty(textMaxTrans.Text))
            {
                int maxTransTemp;
                min = TransitionInstrument.MIN_TRANSITION_MAX;
                max = TransitionInstrument.MAX_TRANSITION_MAX;
                if (!helper.ValidateNumberTextBox(tabControl1, (int)TABS.Instrument, textMaxTrans,
                                                  min, max, out maxTransTemp))
                {
                    return;
                }
                maxTrans = maxTransTemp;
            }
            int?maxInclusions = null;

            if (!string.IsNullOrEmpty(textMaxInclusions.Text))
            {
                int maxInclusionsTemp;
                min = TransitionInstrument.MIN_INCLUSION_MAX;
                max = TransitionInstrument.MAX_INCLUSION_MAX;
                if (!helper.ValidateNumberTextBox(tabControl1, (int)TABS.Instrument, textMaxInclusions,
                                                  min, max, out maxInclusionsTemp))
                {
                    return;
                }
                maxInclusions = maxInclusionsTemp;
            }
            int?minTime = null, maxTime = null;

            min = TransitionInstrument.MIN_TIME;
            max = TransitionInstrument.MAX_TIME;
            if (!string.IsNullOrEmpty(textMinTime.Text))
            {
                int minTimeTemp;
                if (!helper.ValidateNumberTextBox(tabControl1, (int)TABS.Instrument, textMinTime,
                                                  min, max, out minTimeTemp))
                {
                    return;
                }
                minTime = minTimeTemp;
            }
            if (!string.IsNullOrEmpty(textMaxTime.Text))
            {
                int maxTimeTemp;
                if (!helper.ValidateNumberTextBox(tabControl1, (int)TABS.Instrument, textMaxTime,
                                                  min, max, out maxTimeTemp))
                {
                    return;
                }
                maxTime = maxTimeTemp;
            }
            if (minTime.HasValue && maxTime.HasValue && maxTime.Value - minTime.Value < TransitionInstrument.MIN_TIME_RANGE)
            {
                helper.ShowTextBoxError(tabControl1, (int)TABS.Instrument, textMaxTime,
                                        string.Format(Resources.TransitionSettingsUI_OkDialog_The_allowable_retention_time_range__0__to__1__must_be_at_least__2__minutes_apart,
                                                      minTime, maxTime, TransitionInstrument.MIN_TIME_RANGE));
                return;
            }

            TransitionInstrument instrument = new TransitionInstrument(minMz,
                                                                       maxMz, isDynamicMin, mzMatchTolerance, maxTrans, maxInclusions, minTime, maxTime);

            Helpers.AssignIfEquals(ref instrument, Instrument);

            // Validate and store full-scan settings

            // If high resolution MS1 filtering is enabled, make sure precursor m/z type
            // is monoisotopic and isotope enrichments are set
            FullScanPrecursorIsotopes precursorIsotopes = PrecursorIsotopesCurrent;
            FullScanMassAnalyzerType  precursorAnalyzerType = PrecursorMassAnalyzer;

            if (precursorIsotopes != FullScanPrecursorIsotopes.None &&
                precursorAnalyzerType != FullScanMassAnalyzerType.qit)
            {
                if (precursorMassType != MassType.Monoisotopic)
                {
                    MessageDlg.Show(this, Resources.TransitionSettingsUI_OkDialog_High_resolution_MS1_filtering_requires_use_of_monoisotopic_precursor_masses);
                    tabControl1.SelectedIndex = (int)TABS.Prediction;
                    comboPrecursorMass.Focus();
                    return;
                }

                if (FullScanSettingsControl.Enrichments == null)
                {
                    tabControl1.SelectedIndex = (int)TABS.FullScan;
                    MessageDlg.Show(GetParentForm(this), Resources.TransitionSettingsUI_OkDialog_Isotope_enrichment_settings_are_required_for_MS1_filtering_on_high_resolution_mass_spectrometers);
                    FullScanSettingsControl.ComboEnrichmentsSetFocus();
                    return;
                }
            }

            IsolationScheme           isolationScheme = FullScanSettingsControl.IsolationScheme;
            FullScanAcquisitionMethod acquisitionMethod = AcquisitionMethod;

            if (isolationScheme == null && acquisitionMethod == FullScanAcquisitionMethod.DIA)
            {
                tabControl1.SelectedIndex = (int)TABS.FullScan;
                MessageDlg.Show(this, Resources.TransitionSettingsUI_OkDialog_An_isolation_scheme_is_required_to_match_multiple_precursors);
                FullScanSettingsControl.ComboIsolationSchemeSetFocus();
                return;
            }

            if (isolationScheme != null && isolationScheme.WindowsPerScan.HasValue && !maxInclusions.HasValue)
            {
                MessageDlg.Show(this, Resources.TransitionSettingsUI_OkDialog_Before_performing_a_multiplexed_DIA_scan_the_instrument_s_firmware_inclusion_limit_must_be_specified);
                tabControl1.SelectedIndex = (int)TABS.Instrument;
                textMaxInclusions.Focus();
                return;
            }

            if (FullScanSettingsControl.IsDIA() && cbExclusionUseDIAWindow.Checked)
            {
                if (FullScanSettingsControl.IsolationScheme.IsAllIons)
                {
                    MessageDlg.Show(this, Resources.TransitionSettingsUI_OkDialog_Cannot_use_DIA_window_for_precusor_exclusion_when__All_Ions__is_selected_as_the_isolation_scheme___To_use_the_DIA_window_for_precusor_exclusion__change_the_isolation_scheme_in_the_Full_Scan_settings_);
                    tabControl1.SelectedIndex = (int)TABS.Filter;
                    cbExclusionUseDIAWindow.Focus();
                    return;
                }
                if (FullScanSettingsControl.IsolationScheme.FromResults)
                {
                    MessageDlg.Show(this, Resources.TransitionSettingsUI_OkDialog_Cannot_use_DIA_window_for_precursor_exclusion_when_isolation_scheme_does_not_contain_prespecified_windows___Please_select_an_isolation_scheme_with_prespecified_windows_);
                    tabControl1.SelectedIndex = (int)TABS.Filter;
                    cbExclusionUseDIAWindow.Focus();
                    return;
                }
            }

            TransitionFullScan fullScan;

            if (!FullScanSettingsControl.ValidateFullScanSettings(helper, out fullScan, tabControl1, (int)TABS.FullScan))
            {
                return;
            }

            Helpers.AssignIfEquals(ref fullScan, FullScan);

            TransitionSettings settings = new TransitionSettings(prediction,
                                                                 filter, libraries, integration, instrument, fullScan);

            // Only update, if anything changed
            if (!Equals(settings, _transitionSettings))
            {
                if (!_parent.ChangeSettingsMonitored(this, Resources.TransitionSettingsUI_OkDialog_Changing_transition_settings,
                                                     s => s.ChangeTransitionSettings(settings)))
                {
                    return;
                }
                _transitionSettings = settings;
            }

            DialogResult = DialogResult.OK;
        }
Beispiel #9
0
 public void EditIsolationScheme()
 {
     FullScanSettingsControl.EditIsolationScheme();
 }
Beispiel #10
0
 public void AddIsolationScheme()
 {
     FullScanSettingsControl.AddIsolationScheme();
 }
        public TransitionSettingsUI(SkylineWindow parent)
        {
            InitializeComponent();

            // Populate the fragment finder combo boxes
            foreach (string item in TransitionFilter.GetStartFragmentFinderLabels())
                comboRangeFrom.Items.Add(item);
            foreach (string item in TransitionFilter.GetEndFragmentFinderLabels())
                comboRangeTo.Items.Add(item);

            _parent = parent;
            _transitionSettings = _parent.DocumentUI.Settings.TransitionSettings;

            // Initialize prediction settings
            comboPrecursorMass.SelectedItem = Prediction.PrecursorMassType.GetLocalizedString();
            comboIonMass.SelectedItem = Prediction.FragmentMassType.GetLocalizedString();

            _driverCE = new SettingsListComboDriver<CollisionEnergyRegression>(comboCollisionEnergy,
                                                                               Settings.Default.CollisionEnergyList);
            string sel = (Prediction.CollisionEnergy == null ? null : Prediction.CollisionEnergy.Name);
            _driverCE.LoadList(sel);

            _driverDP = new SettingsListComboDriver<DeclusteringPotentialRegression>(comboDeclusterPotential,
                                                                                     Settings.Default.DeclusterPotentialList);
            sel = (Prediction.DeclusteringPotential == null ? null : Prediction.DeclusteringPotential.Name);
            _driverDP.LoadList(sel);

            _driverCoV = new SettingsListComboDriver<CompensationVoltageParameters>(comboCompensationVoltage,
                                                                                    Settings.Default.CompensationVoltageList);
            _driverCoV.LoadList(Prediction.CompensationVoltage == null ? null : Prediction.CompensationVoltage.Name);

            _driverOptimizationLibrary = new SettingsListComboDriver<OptimizationLibrary>(comboOptimizationLibrary,
                Settings.Default.OptimizationLibraryList);
            _driverOptimizationLibrary.LoadList(Prediction.OptimizedLibrary == null ? null : Prediction.OptimizedLibrary.Name);

            if (Prediction.OptimizedMethodType == OptimizedMethodType.None)
                comboOptimizeType.SelectedIndex = 0;
            else
            {
                cbUseOptimized.Checked = true;
                comboOptimizeType.SelectedItem = Prediction.OptimizedMethodType.GetLocalizedString();
            }

            // Initialize filter settings
            textPrecursorCharges.Text = Filter.PrecursorCharges.ToArray().ToString(", "); // Not L10N? Internationalization of comma?
            textIonCharges.Text = Filter.ProductCharges.ToArray().ToString(", "); // Not L10N? Internationalization of comma?
            textIonTypes.Text = TransitionFilter.ToStringIonTypes(Filter.IonTypes, true);
            comboRangeFrom.SelectedItem = Filter.FragmentRangeFirst.Label;
            comboRangeTo.SelectedItem = Filter.FragmentRangeLast.Label;
            textExclusionWindow.Text = Filter.PrecursorMzWindow != 0
                                           ? Filter.PrecursorMzWindow.ToString(LocalizationHelper.CurrentCulture)
                                           : string.Empty;
            cbExclusionUseDIAWindow.Checked = Filter.ExclusionUseDIAWindow;
            cbAutoSelect.Checked = Filter.AutoSelect;

            _driverIons = new MeasuredIonListBoxDriver(listAlwaysAdd, Settings.Default.MeasuredIonList);
            _driverIons.LoadList(Filter.MeasuredIons);

            // Initialize library settings
            cbLibraryPick.Checked = (Libraries.Pick != TransitionLibraryPick.none);
            panelPick.Visible = cbLibraryPick.Checked;
            textTolerance.Text = Libraries.IonMatchTolerance.ToString(LocalizationHelper.CurrentCulture);
            textIonCount.Text = Libraries.IonCount.ToString(LocalizationHelper.CurrentCulture);
            if (Libraries.Pick == TransitionLibraryPick.filter)
                radioFiltered.Checked = true;
            else if (Libraries.Pick == TransitionLibraryPick.all_plus)
                radioAllAndFiltered.Checked = true;

            // Initialize instrument settings
            textMinMz.Text = Instrument.MinMz.ToString(LocalizationHelper.CurrentCulture);
            textMaxMz.Text = Instrument.MaxMz.ToString(LocalizationHelper.CurrentCulture);
            cbDynamicMinimum.Checked = Instrument.IsDynamicMin;
            textMzMatchTolerance.Text = Instrument.MzMatchTolerance.ToString(LocalizationHelper.CurrentCulture);
            if (Instrument.MaxTransitions.HasValue)
                textMaxTrans.Text = Instrument.MaxTransitions.Value.ToString(LocalizationHelper.CurrentCulture);
            if (Instrument.MaxInclusions.HasValue)
                textMaxInclusions.Text = Instrument.MaxInclusions.Value.ToString(LocalizationHelper.CurrentCulture);
            if (Instrument.MinTime.HasValue)
                textMinTime.Text = Instrument.MinTime.Value.ToString(LocalizationHelper.CurrentCulture);
            if (Instrument.MaxTime.HasValue)
                textMaxTime.Text = Instrument.MaxTime.Value.ToString(LocalizationHelper.CurrentCulture);

            // Initialize full-scan settings
            FullScanSettingsControl = new FullScanSettingsControl(_parent)
                                          {
                                              Anchor = (AnchorStyles.Top | AnchorStyles.Left),
                                              Location = new Point(0, 0),
                                              Size = new Size(363, 491)
                                          };
            FullScanSettingsControl.IsolationSchemeChangedEvent += IsolationSchemeChanged;
            tabFullScan.Controls.Add(FullScanSettingsControl);

            // VISUAL:
            // - Store the distance between the cbExclusionDIAWindow and the lower end of the box (to use as margin later)
            // - Shift the cbExclusionDIAWindow down (it is only higher in the designer for better manipulation)
            _lower_margin = groupBox1.Height - textExclusionWindow.Location.Y - textExclusionWindow.Height;
            int pixelShift = cbExclusionUseDIAWindow.Location.Y - lbPrecursorMzWindow.Location.Y;
            cbExclusionUseDIAWindow.Location = new Point(cbExclusionUseDIAWindow.Location.X, cbExclusionUseDIAWindow.Location.Y - pixelShift);

            DoIsolationSchemeChanged();
        }