IsoCor v2.2.2

Changelog

• add support of Python 3.12
• drop Python 3.6

Isocor v2.2.1

Changelog

Core

• fix: GUI could not open because of changed signature of tk.StringVar() (#25 and #27)

Misc.

• switch CI/CD from Travis to GitHub actions
• add support of Python 3.9, 3.10, 3.11

IsoCor 2.2.0

Changelog

Core

• fix: returns complete correction vectors and matrices (#18 )
• feat: add support and generation of isotopic inchis (#19 )

Misc.

• add support of python 3.8 in travis
• update doc

IsoCor 2.1.4

Changelog

GUI

• fix: scroollbar for tracer purity is functional (#15)
• feat: tooltips for the GUI (#13)
• feat: display logs progressively in the GUI
• feat: display some text if local IsoCor's version is outdated (#14)

... and some more tuning.

Misc.

• chore: new image displaying IsoCor GUI
• feat: maintain only one version number in __init__.py

IsoCor 2.1.3

Changelog

• fix: encoding of datafiles path to utf-8 #9
• feat: improved checks when parsing database files, clearer error messages #9

IsoCor 2.1.2

Changelog

• fix: parsing error when names of samples contained only numbers
• feat: improved CLI interface (test correction parameters early and exit on error)
• added reference to IsoCor v2 publication
• and updated doc

IsoCor 2.1.1

Changelog

• update of the doc

IsoCor 2.1.0

Changelog

• feat: resolution can be provided in the measurements file for each metabolite (using 'datafile' as 'resolution formula')
• feat: correction can be applied to singly- and multiply-charged ions (NOTE: if you have a previous installation of IsoCor, you will have to provide the 'charge' for each compound in your metabolite database 'Metabolites.dat')
• fix: minor bugs in GUI
• and update of the doc

IsoCor 2.0.5

Changelog

• fix: compatibility issue with Python 3.5 #4

IsoCor 2.0.4

Changelog

• fix: mass fractions of metabolites are sorted by isotopologue to create the measurement vector