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theoretical spectra of crosslinked peptides #92

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FraenzeMueller opened this issue Oct 9, 2023 · 2 comments
Open

theoretical spectra of crosslinked peptides #92

FraenzeMueller opened this issue Oct 9, 2023 · 2 comments

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@FraenzeMueller
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Dear Lutz,

Is it possible to use this tool (peptide2ions.PeptideToIonWindow) entirely in command line mode, meaning to pass a list of several peptides, charge states and linkage sites through the function and get a .csv or .txt file out?

Best wishes,
Fränze
@lutzfischer
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not at the moment - can have a look how much work it would be.

@FraenzeMueller
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yes, please. it would be awesome to be able to use it.

Best wishes

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@lutzfischer @FraenzeMueller