Ming Wang comments

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                                            Ming Wang

Possible inconsistencies

You won't be able to put the MSLEVEL in the conditions, you might be able to put it in the filter section. Since you want to match MS1 and MS2...

MS3 Support

TMT Example: https://gnps-lcms.ucsd.edu/#%7B%22usi%22%3A%20%22mzspec%3AMSV000086387%3Accms_peak/RAW/SecondInstrument_Sample5_S2R11_121815_Fr03.mzML%22%2C%20%22usi2%22%3A%20%22%22%7D MS2:59796

[Workflow] Create an early check step that causes a failure for validation of the query

Nice to have but not super necessary.

Refine and finalize metadata and CV terms

I'm not sure if this is addressed in the Massbank format or other formats, but one things we try to track on the GNPS side is the provenance filename and...

Suspect library MSP file empty

Thanks Wout, we'll take a look at this. Best, Ming On Mon, Feb 19, 2024 at 5:15 AM Wout Bittremieux ***@***.***> wrote: > *Describe the bug* > > The MSP...

Update msdial_formatter.py

Thanks @chrispook, if you do have an example, that would be awesome. We can add it to our unit tests. I think it might be worth also having v4.7 and

Update msdial_formatter.py

The already formatted version is MZmine, so go ahead and select that and give it a go.

Update msdial_formatter.py

Thanks @chrispook will take a look soon.

Feature quantification table import in FBMN with Mzmine workflow

you need the feature table for FBMN. If you dont have it, it wont work. It is required.

[FBMN] Import libraries for search

Hi @zinuo-H, in GNPS, libraries have to be added to the system. Its meant to eventually make the spectral libraries public so it can help the entire community. You can...