IsotopicDistributionMod {adductomicsR}R Documentation

modified function from package OrgMassSpecR

Description

modified function from package OrgMassSpecR

Usage

IsotopicDistributionMod(formula = list(), charge = 1)

Arguments

formula

list of character strings representing elemental formula

charge

numeric for charge of the element

Value

dataframe of a spectrum

Examples

IsotopicDistributionMod(formula=list("CH3CH2OH","H2O"),charge = 1)

[Package adductomicsR version 1.10.0 Index]