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rformassspectrometry / CompoundDb

Creating and using (chemical) compound databases
https://rformassspectrometry.github.io/CompoundDb/index.html
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Prepare for Bioconductor submission #90

Closed jorainer closed 2 years ago

jorainer commented 2 years ago

Prepare for submission to Bioconductor. Cleaning up code and un-needed (redundant) functionality.

jorainer commented 2 years ago

@stanstrup , @jmbadia , did any of you use the annotateMz function? I would like to remove that because we have a matchMz function in the MetaboAnnotation package that has more options and is better.

jmbadia commented 2 years ago

No, I was using compareSpectra to compare its features with the annotate function of MS2ID. I'll be more than happy to check your new matchMz :)

jorainer commented 2 years ago

CompoundDb was submitted to BioC - waiting for review.