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Matthias Mailänder edited this page Oct 30, 2024 · 146 revisions

1.5.0

20241030

  • Added an Agilent OpenLab HPLC-UV/Vis converter. OpenChrom#565
  • Added shorter names for Chromatogram Filters. ChemClipse#1922
  • Added support for a trace 0 - 0 range indicating the whole range. ChemClipse#1920
  • Added highlights in PCA plot when selected in sample list and vice versa. ChemClipse#1918
  • Added help button to the PCA perspective. ChemClipse#1916
  • Added a view to display the noise factor used to calculate the s/n ratio. ChemClipse#1915
  • Added box selection in PCA score plot. ChemClipse#1914
  • Added a View menu in the main menu matching the toolbar buttons to switch views. ChemClipse#1913
  • Added a visual selection box to the PCA loading plot. ChemClipse#1911

20241018

20241011

  • Fixed a regression where ions would be zero with TIC still intact in Agilent LC-MS data.
  • Fixed a crash in .mzXML MALDI-TOF MS data ChemClipse#1895
  • Fixed a crash in .mzData reader when fields are missing ChemClipse#1894
  • Fixed white spaces at the end of peak labels marked as unknown. ChemClipse#1888
  • Added a reader for Applied Biosystem / SCIEX MALDI TOF/TOF data.OpenChrom#550
  • Added a report writer that takes *.xlst as template. OpenChrom#549
  • Added support for full centroided spectrum .mzDB not just TIC data. OpenChrom#546
  • Added peak delete filter to be able to remove inactive or active peaks for analysis. ChemClipse#1892
  • Added automatic migration of process methods to newer version ChemClipse#1891
  • Added a retention index assigner dialog. ChemClipse#1884
  • Added a obfuscator that replaces ions in scans/peaks with a random TIC value. ChemClipse#1883
  • Added ppm and ± notation for high resolution MS data. ChemClipse#1886

20240927

20240920

20240913

  • Windows setup installer now requires admin rights.
  • Added new Windows self-extracting archive for portable installation.
  • Fixed Shimadzu chromatograms not being shown when the PDA chromatogram is empty.
  • Time Ranges List is now sorted by start time by default ChemClipse#1867
  • Added converter error highlighting in the Feedback tab. ChemClipse#1866
  • Added mzML HPLC-DAD read/write support ChemClipse#1863
  • Added process method ID when copying and pasting. ChemClipse#1864
  • Added update of Feature Table Selection from Loading Plot on double-click- ChemClipse#1862
  • Added FAQ to converter error dialog.

20240906

20240830

  • Removed PCA filter options. ChemClipse#1844
  • Removed PCA option to filter variables which contains less than two values. ChemClipse#1842
  • Added a right-click toggle for multiple items at once in PCA feature table. ChemClipse#1843
  • Added more reusable converter related texts for natural language translation. ChemClipse#1837
  • Fixed a regression regarding Save As 💾 in Database Editor when not using drag and drop. ChemClipse#1841
  • Fixed a regression where Agilent *.L libraries would not open.

20240816

  • Fixed Windows installer ignoring the installation directory parameter.
  • Fixed login dialog not asking for a password again after entering a wrong one.

20240809

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20220902

20220819

  • Added a build optimized for Apple M1.
  • Added icons to CSV report and template processors. OpenChrom#296
  • Added a tabular input to the template integrator. OpenChrom#295
  • Added support for .btmsp databases consisting of multiple main spectra projections. OpenChrom#294
  • Added a reference identifier column to the Peak Quantitation list. ChemClipse#1111
  • Added a delete quantitation references Peak Filter ChemClipse#1110
  • Added a title based on user input in the PCA editor ChemClipse#1107
  • Added a Scan Duplicator filter to artificially increase the scan density ChemClipse#1104
  • Fixed signal value in Scan Chart and Scan Table maxing out at a fixed value ChemClipse#1100
  • Fixed diagram reset always selecting the first peak ChemClipse#1106
  • Fixed hidden editor toolbars not updating with more than one chromatogram ChemClipse#1105

20220805

20220714

  • Added user configurable .csv and .xlsx PCR reports. ChemClipse#1086
  • Added a gray scale color scheme to Chromatogram Overlay. ChemClipse#1082
  • Changed the Peak Detector Template file extension to *.pdt OpenChrom#280

20220708

  • Added an optimal low-resolution MS ion rounding scheme. ChemClipse#1081
  • Added undo/redo to Savitzky-Golay smoothing on MSD chromatograms ChemClipse#1079
  • Added an option to the Peak Integrator to disallow negative areas. ChemClipse#1078
  • Fixed combo box background being transparent on Ubuntu's default Yaru theme. ChemClipse#1080

20220701

20220614

  • Added a filter to delete peaks by a given quantitation limit. ChemClipse#1062
  • Added support for classifying mass spectra from databases. ChemClipse#1061
  • Added a tab to switch in the Targets list. ChemClipse#1060
  • Removed optional plural forms from UI labels. ChemClipse#1058
  • Changed the Named Traces file extension to *.ntr ChemClipse#1057
  • Changed the Time Ranges file extension to *.tra. ChemClipse#1056
  • Fixed measurement overlays never disappearing. ChemClipse#1055
  • Added functionality to create a combined spectrum from a list of spectra. ChemClipse#1054
  • Changed Peak Identifier Template file extension to *.pit OpenChrom#275
  • Added quantitation for the selected peak to Peak Review UI. OpenChrom#274
  • Added manual targets to the Template Review UI. OpenChrom#273
  • Changed the Peak Review Template file extension to *.prt. OpenChrom#272
  • Changed the Time Ratio Classifier file extension to *.tir. OpenChrom#271
  • Added support for Time Ratio Classifier via process methods. OpenChrom#271
  • Added a compiler for peaks and scans in the Time Ratio Classifier. OpenChrom#271
  • Changed the Trace Ratio Classifier file extension to *.trr. OpenChrom#270
  • Added support for Trace Ratio Classifier via process methods. OpenChrom#270
  • Added a compiler for peaks and scans in the Trace Ratio Classifier. OpenChrom#270
  • Changed Named Traces file extension to *.ntr OpenChrom#270
  • Changed Time Ranges file extension to *.tra OpenChrom#270

20220527

  • Fixed selected / combined scan buttons being enabled when no chromatogram is loaded. ChemClipse#1052
  • Added an option to identify a chromatogram against a Library File (MS) entry. ChemClipse#1053
  • Added possibility to create a Combined Scan from chromatogram selection and peaks instead of scans. ChemClipse#1051
  • Added an *.msl export converter for the Combined Scan part. ChemClipse#1050
  • Added a system setting for MSD model preferences. ChemClipse#1049
  • Fixed input popup appearing when no chromatogram is set in Time Ranges Chart. ChemClipse#1043
  • Fixed PCR editor save as crashing on @KDE. ChemClipse#1040
  • Fixed zero values being ignored in the HPLC-DAD ARW converter. ChemClipse#1037

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