This function calculates the isotope abundances (in statistics error from the raw ion counts. It can be applied to data from both LANS_summary and LANS_maps loading but can be slow if LANS_maps is combined from many analyses.
calculate_abundances(data, ..., name_fun = default_name, quiet = FALSE)
| data | a data frame with raw ion counts retrieved from |
|---|---|
| ... | the fractional abundances to calculate, each entry is for one fractional abundance with major isotope first, then minor isotope, e.g. c(`13C`, `12C`), c(`15N12C`, `14C12C`), ... |
| name_fun | the naming function, receives ... from the top level, default concatenates 'F' + minor ion name |
| quiet | whether the function should output information messages or be quiet (default is to output) |
the original data frame with the fractional abundance information appended (all fractional abundances are in
Other calculations:
calculate_ratios(),
calculate_sums(),
calculate()