annotateFA {FAMetA}

FA annotation

Description

FA annotation

Usage

annotateFA(msbatch, dmz = 5, rt, adducts = c("M-H"), db)

Arguments

msbatch

msbatch obtained from LipidMS package.

dmz

mz tolerance in ppm.

rt

Optional. Numeric vector of length two specifying the rt range to search for FA.

adducts

character vector specifying adducts.

db

FA database. Data frame with three columns: formula, total (number of carbons and double bounds, i.e. "18:1") and Mass.

Value

annotated msbatch.

Author(s)

M Isabel Alcoriza-Balaguer <[e-mail]>

Examples

## Not run: 
msbatch <- annotateFA(msbatch, dmz = 5)

## End(Not run)