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Releases: AutoFlowResearch/SmartPeak

v1.27.0

12 Feb 20:45
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v1.26.0

19 Sep 06:51
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  • Using latest OpenMS modifications related to DDA implementation

v1.25.0

02 Aug 08:12
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Features

  • Added option to display only spectrogram data that contains convexhull (#545)

Fix

  • Optimized commands creations (#543)
  • prioritized the use of subordinate metadata when choosing between feature level and subordinate level (#544)
  • update to feature map after call to targetedMatching (#544)
  • added rawDataHandler member for Library (#544)
  • matchSpectra requirements for msp (#544)
  • changed getRequirements to getFilenameRequirements (#544)
  • renamed library to spectra library (#544)
  • updated RawDataHandler pointer logic for spectra_library (#544)

v1.24.0

25 May 13:42
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Features

  • Removed scan explorer window (#540)

Fix

  • Fix StoreFeatureBackgroundEstimations and generalized export to other storing processors (#536)
  • Fix/missing report metadata values (#541)

v1.23.0

02 May 13:29
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  • DDA Implementation (#534)
    • Added "LCMS DDA Transitions Library Construction" workflow
    • Added "LCMS DDA Spectra Library Construction" workflow
    • Added "LCMS DDA Spectra Library Matching" workflow
    • PickMS1Features renamed Pick2DFeatures
    • PickMS2Features renamed Pick3DFeatures

v1.22.0

12 Apr 06:35
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Features

  • Number of running threads is now an input on the Run Workflow Dialog (#529)
  • Log messages improved (#528)
  • Create output folder (#527)

Fix

  • Fix loading and exporting for FeatureBackgroundEstimations, FeatureRSDEstimations, QuantitationMethods and StandardsConcentrations (#532)
  • Fix inclusion/exclusion of points for multiple Calibration display (#531)

v1.21.0

21 Mar 07:51
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  • Possibility to export Quantitations Methods (#522)
  • Improving Calibration curve window: Possibility to exclude points, show chromatogram, editable parameters (WARNING: CALCULATE_CALIBRATION has been renamed OPTIMIZE_CALIBRATION) (#515)
  • Show Inputs and Outputs in Workflow Step display (#520)
  • Transformation_model_param_x_weight and transformation_model_param_y_weight do not accept empty values (replaced by 'x' and 'y') (#519)
  • New Workflow Steps display (#517)
  • Check missing or wrong columns for Quantitations Methods and Standards Concentrations files (#512)
  • Check csv files BOM (#513)

v1.20.0

27 Jan 10:02
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  • Improving Calibration curve display: show parameters, zooming, outlier points (#507)
  • Improving logs: wrapping, auto scroll and line hovering (#509)
  • Improving zooming on plots (#508)
  • Using native system file picker (ImGui flavor still available as an option) (#505)
  • Adding server building files (#496)

v1.19.0

18 Jan 10:22
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Features

  • Walkthrough : Non-targeted FIA-MS analysis with Thermo Orbitrap (#460)
  • doc : Targeted flux analysis with LC-MS/MS Agilent Lipidomics (#473)
  • Walkthrough: Targeted flux analysis with GC-MS full-scan Agilent (#476)
  • Marking highest values in 2D Plots (#475)
  • Report Doalog box now confirms success or error once the report is created (#480)
  • Distributed Mode (#437)

Fix

  • Fixed session error due to regex (#478)
  • Fix some file picker don't popup when selecting file in the New Session dialog box (#479)

Changes

  • upgrade CI macOS build to 13.1 (#472)

v1.18.0

16 Dec 14:47
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Features

  • ReadTheDocs Walkthrough : Targeted quantitation with HPLC data (#454)
  • UI Splitting and Docking (#464)
  • Support for small screens (#466)
  • Enabled viewports (#467)
  • Increased max points to be displayed to 10 millions (#470)

Fix

  • Fixing SVG exports and deprecating HTML support (#458)
  • Fixing FIAMS workflow and quantitationMethods.csv override (#461)
  • Fixed Cancel button size for directory selection dialog box (#469)