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TODO.md

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Important

  • write CLI

Elegant

  • analysis of fitting sensitivity
  • l1 optimization algorithm
  • get rid of the intervaltree
  • passing of the parameter:
    • the parameters should be stored as dictionaries.
    • the docs should have references to check up on them.
  • write a test comparing the output of different deconvolution methods.
  • get rid of these set themes:
    • the user should decide about this
    • create a separate module for pictures management
  • the ppm intervals might overlap!!!

DONE:

  • quality of fit
    • errors for each deconvolution problem
    • writing down to csv
  • rewrite the paper
    • plots with multiple experiments in the paper
    • simplify the picts on deconvolution
  • multiprocessing batch files
    • run on all orbitrap data
    • run on all previous data
      • compare with last results
  • adjust masstodon for non-orbitrap data
    • providing the interval length
    • assure that different intervals do not intersect
      • if they do, make them shorter