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

Not all compounds in summaries #130

Open
MilouArts opened this issue Aug 9, 2023 · 0 comments
Open

Not all compounds in summaries #130

MilouArts opened this issue Aug 9, 2023 · 0 comments

Comments

@MilouArts
Copy link

I used sirius to predict molecular formulas on 27129 features (till 850 da, 27856 features total)
Zodiac doesn't run because it takes too much memory and SIRIUS crashes (but that is not the problem here), but I also ran CSI:FingerID and Canopus. This all in steps and over the last weeks.

now I write the summaries and it only gives me a list of 437 features for formula identification, while if I look inside the folders of features that are not in the list, they do have formula candidates.

Canupus output is completely empty.

Is this a bug or am I missing something why the information is not ending up in the summary files?

Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment
Labels
None yet
Projects
None yet
Development

No branches or pull requests

1 participant