Core Utils for Metabolomics Data


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Documentation for package ‘MetaboCoreUtils’ version 1.0.0

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addElements Combine chemical formulae
adductNames Retrieve names of supported adducts
adducts Retrieve names of supported adducts
containsElements Check if one formula is contained in another
countElements Count elements in a chemical formula
internalStandardMixNames Get names of internal standard mixes provided by the package
internalStandards Get definitions for internal standards
mass2mz Calculate mass-to-charge ratio
mz2mass Calculate neutral mass
pasteElements Create chemical formula from a named vector
standardizeFormula Standardize a chemical formula
subtractElements subtract two chemical formula