multiform: Multiply a chemical formula
In enviPat: Isotope Pattern, Profile and Centroid Calculation for Mass Spectrometry
multiform R Documentation
Multiply a chemical formula
Description
Multiply all atom numbers in a chemical formula by a factor
Usage
multiform(formula_in,fact)
Arguments
formula_in
Chemical formula to be multiplied, vector of character strings
fact
Factor to multiply with
Details
Useful for adduct calculations, check adducts.
Chemical formulas must conform to what is described in check_chemform.
Value
Multiplied chemical formula, character string
Author(s)
Martin Loos
See Also
adducts
Examples
formula_in <- "C10[13]C2H10Cl10"
multiform(formula_in, 3)
enviPat documentation built on Oct. 21, 2022, 5:06 p.m.
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| multiform | R Documentation |
Multiply a chemical formula
Description
Multiply all atom numbers in a chemical formula by a factor
Usage
multiform(formula_in,fact)
Arguments
formula_in |
Chemical formula to be multiplied, vector of character strings |
fact |
Factor to multiply with |
Details
Useful for adduct calculations, check adducts.
Chemical formulas must conform to what is described in check_chemform.
Value
Multiplied chemical formula, character string
Author(s)
Martin Loos
See Also
adducts
Examples
formula_in <- "C10[13]C2H10Cl10" multiform(formula_in, 3)
R Package Documentation
Browse R Packages
We want your feedback!
Note that we can't provide technical support on individual packages. You should contact the package authors for that.
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