Closed edkerk closed 5 months ago
This PR has been automatically tested with GH Actions. Here is the output of the tests:
GECKO installed, unknown version (cannot find version.txt).
Running geckoCoreFunctionTests
Done geckoCoreFunctionTests
__________
Note: In the case of multiple test runs, this post will be edited.
Main improvements in this PR:
getStandardKcat.m
removed enzymes when it was run on a model already containing standard kcat valuesecFVA
will swapmin
andmax
values the reaction directionality was swapped when mapping from ec- to conventional modelplotEcFVA
will use its owncdfplot
function, to avoid dependency on MATLAB Statistics and Machine Learning Toolbox. Blocked reactions are excluded from the graph. ⚠️ The plot infull_ecModel
shows minor differences, also due to code changes introduced by GECKO 3.2.0can handle
protData` with multiple conditions (in which case, averages over all conditions are taken)setKcatForReactions
allows multiple kcat values as input, allowing to set kcat of multiple reactions at the same timereportEnzymeUsage
will report both the summed usage of isoenzymes, as well as the individual usage of the separate reactions.topUsage
andhighCapUsage
outputs columns are harmonizedconstrainFluxData
if a provided constraint is either -1000 or 1000, lower and upper bound will be constraint to either uptake or excretion only, irrespective of what option is given as thelooseStrictFlux
parameterconstrainEnzConcs
can also remove enzyme concentration constraintsfuzzyKcatMatching
to avoid warnings "Colon operands must be real scalars" in recent MATLAB versionsInstructions on merging this PR:
develop
as target branch, and will be resolved with a squash-merge.main
as target branch, and will be resolved with a merge commit.