checkElement: checkElement

checkElementR Documentation

checkElement

Description

Check a formula can add one adduct or not.

Usage

checkElement(formula = "C9H11NO2", adduct = "M-H2O+H")

Arguments

formula

The formula of metabolite.

adduct

The adduct.

Value

valid, return TRUE; invalid.

Author(s)

Xiaotao Shen shenxt@sioc.ac.cn


ZhuMSLab/MetDNA documentation built on March 29, 2022, 5:45 p.m.