TODO.md

To-Do List

To Do

• Add comparison plot of initial spectrum in measurement data with epsilon spectrum

• Add general options for data processing

  • Baseline correction of LED emission spectrum (move to general)
  • Smoothing of LED emission spectrum
  • Fitting of Gaussian shapes to spectra

• Add instructions video

In Progress :)

• Create Results folder upon saving the results and save all data used into that folder

  • Include processed data, fits, etc., with results (to allow subsequent plotting by the user)
  • Save Concentrations Results (experimental and fitted)
  • Save Reconstructed Spectra and Residuals from Fractions calculation

• Automatically show newly generated tab

• Change residuals plot in QY Results: absolute residual of R; relative residual/normalised of R

• Improve QY Results plot of absorption spectra (fit vs experimental): show residuals in a separate window

• Introduce DPI auto-scaling to accommodate all screen resolutions

• Include uncertainty in epsilon data

Completed ✓

• Release version 1.1.1
• Indicate baseline in loaded spectra to facilitate checking of negative values for user
• Error handling
  • Put functions in "try"-statements to catch errors and prevent crashing
  • Upon save results: do not overwrite existing filename
• Add status field that shows message log
• Release version 1.1.0
• Introduce alternative Concentrations method for solving the ODEs: involves initial retrieval of concentrations from absorption spectra by fitting of epsilons spectra (version 1.1.0)
• Take into account delays around acquisition of spectra; use actual irradiation times (shift timestamps) for ODE
• Release version 1.0.0
• Create CITATION.cff
• Add configuration file to set defaults (e.g., for Log format)
• Enable closing of tabs
• Load UI files as .py files generated by pyuic (instead of .ui files) => program can be called from anywhere
• Fix crash upon pressing cancel button in Save Results file window
• Add button to clear loaded data
• Simplify installation instructions