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Add Spectronaut support #372

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brvpuyve opened this issue Sep 4, 2024 · 6 comments
Closed

Add Spectronaut support #372

brvpuyve opened this issue Sep 4, 2024 · 6 comments
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DIA quantification - peptidoform/precursor ion documentation Improvements or additions to documentation

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@brvpuyve
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brvpuyve commented Sep 4, 2024

=> Input files: https://cloud.cmb.ugent.be/index.php/s/zdGB3zZ7Fwed9gq?path=%2FModule_4_DIA_Quantification%2FSpectronaut

In the parameter file no clear definition of MS1 and MS2 tolerance:
│ ├─ MS1 Mass Tolerance Strategy: System Default
│ └─ MS2 Mass Tolerance Strategy: System Default

@brvpuyve
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brvpuyve commented Sep 5, 2024

Can someone also help out with the documentation on Spectronaut? @wolski @AnStaes

@brvpuyve brvpuyve added the documentation Improvements or additions to documentation label Sep 5, 2024
@rodvrees
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rodvrees commented Sep 5, 2024

@brvpuyve, none of the input files have species information. E.g. there's no columns with <gene_name>_HUMAN or <gene_name>_YEAST output, which is necessary.

@brvpuyve
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brvpuyve commented Sep 6, 2024

@rodvrees Witold reran the analysis with some changed parameter settings which should have resolved the loss of species information. The files have been uploaded to the Cloud server.

@rodvrees
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rodvrees commented Sep 17, 2024

Spectronaut output parsing is now ready (#399). Instead of the user having to fiddle with settings to assure the species information is present, we've implemented a mapping step so that gene names get mapped to the correct protein descriptor.

e.g. Q8WWZ7 (in spectronaut output) will be mapped to sp|Q8WWZ7|ABCA5_HUMAN.

This will also apply for FraggerDIA output, which has the same issue

@brvpuyve
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Great, thanks Robbe!

@wolski
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wolski commented Nov 15, 2024

Spectronaut support completed with PR #437

@wolski wolski closed this as completed Nov 15, 2024
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