Skip to content
New issue

Have a question about this project? Sign up for a free GitHub account to open an issue and contact its maintainers and the community.

By clicking “Sign up for GitHub”, you agree to our terms of service and privacy statement. We’ll occasionally send you account related emails.

Already on GitHub? Sign in to your account

[MetaCyc] GIBBS-0 and STD-REDUCTION-POTENTIAL in reversible reactions #31

Open
y1zhou opened this issue Apr 3, 2022 · 0 comments
Open
Labels
bug Something isn't working

Comments

@y1zhou
Copy link
Owner

y1zhou commented Apr 3, 2022

When parsing the reactions.dat file, we're matching the entries to the nodes in the graph based on the UNIQUE-ID and metaId. However, the sides in reactions.dat and metabolic-reactions.xml could be swapped, i.e. LEFT in the dat file could be Product in the SBML file.

For irreversible reactions, this is fixed in MetacycClient.fix_reaction_direction where we always assume the directions in the SBML file are true. For reversible reactions, this becomes a problem as GIBBS-0 and STD-REDUCTION-POTENTIAL could be reversed.

@y1zhou y1zhou added the bug Something isn't working label Apr 3, 2022
Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment
Labels
bug Something isn't working
Projects
None yet
Development

No branches or pull requests

1 participant