getFormula: Get formula and neutral mass for annotated compounds

Description Usage Arguments Value Author(s)

View source: R/internaldbs.R

Description

Get formula and neutral mass for annotated compounds.

Usage

1
getFormula(df, dbs)

Arguments

df

data frame with the input results

dbs

list of data bases required for annotation. By default, dbs contains the required data frames based on the default fragmentation rules. If these rules are modified, dbs may need to be supplied. See createLipidDB and assignDB.

Value

Data frame

Author(s)

M Isabel Alcoriza-Balaguer <maialba@alumni.uv.es>


LipidMS documentation built on July 7, 2021, 9:07 a.m.