Software releases
🎉 New Features
Introduce interferent signals to EMSC model based preprocessing by labeling those spectra in
interferent_sample
column of metadata table and specifying their type intype
columnInverted X-axis option for all plots

- Slider manual input option for all sliders

- Hard modeling (HM) for feature extraction by fitting selected peaks

- Interface for setting fitted peaks for hard modeling

- Analysis of subtracted spectra (e.g. subtract control sample from treated)

🐞 Bug Fixes
- Step Data, metadata refresh after a new dataset upload
- Quality filters title alignment
🔨 Other updates
- Plot standard data ('standard', 'standard_intensity', 'reference_sample', 'interferent_sample', 'dark_bg') in 'Mean spectra (raw data)' plot
- Despiking step, new interval for Despiking threshold slider
- Quality plots, tooltips added

ATTENTION! Model compatibility with previous versions is not supported!
🎉 New Features
Import functions into python 3.10.4 by importing
server/pyRamanmetrix.py
file, e.g.import pyRamanmetrix as rm
(see Tools / Python module pyRamanmetrix)Multi-response PLS regression (PLS2 and PLSW2A) models
Support of WITec (*.wip) files with Raman spectra (see Data Input / Data structure Types)
Difference spectra plot at model step
Export -> Default parameters
in high-level expertise mode
🐞 Bug Fixes
Appearance of a blank screen at the first start
Support
\
in file path in metadata tableFix PLS2-DA decision-making for values outside of [0; 1] range
Avoid an error if a date cannot be recognized
Allow unsorted standard peaks in parameters.txt
Preserve zoom on saving figures as PNG
🔨 Other updates
- Inclusion of wavenumber range boundary values
🎉 New Features
added PLS2-DA (classification) and PLS1 (regression) models
changed design of the license window
🐞 Bug Fixes
updated labels order in scatterplot legend
avoid erasing imported raw data when the import of metadata fails
fixed breaking of the layout on window resize
🎉 New Features
- improved, fixed bugs and changed view for "included labels" feature in the model construction step
🐞 Bug Fixes
fixed errors for the sliders on the normalization and quality filters steps, that occurred when the selected calibration degree parameter is a decimal number
corrected typos in the tooltip blocks
🎉 New Features
added possibility to use reference spectra for EMSC and quality check (should be marked using 'reference_sample' column in metadata) instead of the mean over the dataset (see reference_sample in the Metadata Table)
added SD to means.csv in results
added major vote predictions (if applicable) to results
🐞 Bug Fixes
fixed bugs related to float values used as labels
fixed problem with endless animation on downloads
🔨 Other updates
optimized default parameters
added link in the menu to the documentation website
displayed errors on upload/download data
updated About page: design and list of packages
general improvements on stability, updated dependencies
🎉 New Features
improvements of data integrity, added md5 sum for models
support of JDX and Renishaw TXT files, support of Horiba XY and TXY maps (see Supported Devices)
display warnings when failed to import files
🐞 Bug Fixes
bugs fixed for test data report and voting after a quality check
fixed appearance of the scatter plot in the test data prediction
🔨 Other updates
added plot with calibration functions to the test report
improved scatterplot: one can choose a type of the scatterplot diagonal plot (line, histogram, distribution)
🎉 New Features
added possibility to stop calculations at any step
aggregation of prediction results by voting
import metadata tables separately
🔨 Other updates
updated component for displaying backend errors
display notification about the new version
added voting results to the reports
minor bug fixes
ATTENTION! This version requires new license file!
🎉 New Features
dark mode
possibility to link license by HDD instead of MAC-address (no conflict with VPN)
usage of all available labels to exclude data from model
🐞 Bug Fixes
- some unexpected installation problems solved
🔨 Other updates
- improved quality of the plots saved in PNG format
🔨 Updates
New name and icon, added an average spectra to the model step, updated user interface, improved plots (see Interactive plots), and fixed bugs.
🎉 New Features
Added 2-level cross-validation
Implemented automated optimization for a number of features
🎉 New Features
- Add 'shift' option on the Standard spectrum plot.
Other updates
- Improved despiking algorithm
...