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Check relInt function in HRMS #32

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jsaintvanne opened this issue Mar 7, 2023 · 1 comment
Open

Check relInt function in HRMS #32

jsaintvanne opened this issue Mar 7, 2023 · 1 comment
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@yguitton @jsaintvanne
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@jsaintvanne
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We were working to add a ndigit parameter for HRMS but the RelInt function use this :

 common.masses <- pat[pat[, 1] %in% refpat[, 1], 1]
    expI <- pat[pat[, 1] %in% refpat[, 1], 2]
    DBI <- refpat[refpat[, 1] %in% pat[, 1], 2]

This compare exact masses but in HRMS it could be better with a mass tolerance deviation maybe ?
@jsaintvanne
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This close PR could help to add ndigit param #29

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@yguitton @jsaintvanne