theoretical spectra of crosslinked peptides

Rappsilber-Laboratory / XiSearch

XiSearch

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theoretical spectra of crosslinked peptides #92

Open FraenzeMueller opened 11 months ago

FraenzeMueller commented 11 months ago

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 commented 11 months ago

not at the moment - can have a look how much work it would be.

FraenzeMueller commented 11 months ago

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

Best wishes