parse_mf: Parse Molecular Formulae to Obtain Elemental Counts

View source: R/parse_mf.R

parse_mfR Documentation

Parse Molecular Formulae to Obtain Elemental Counts

Description

Construct elemental count columns based on provided molecular formulae

Usage

parse_mf(ftmsObj)

Arguments

ftmsObj

an object of class 'ftmsData', typically a result of as.peakData.

Details

Parses molecular formulae for number of observed elements.

Value

an object of class 'ftmsData' with a column in e\_meta giving the molecular formula.

Author(s)

Lisa Bramer


EMSL-Computing/fticRanalysis documentation built on Dec. 18, 2024, 9:51 p.m.