This function prepares spectra for export
Usage
export_spectra(file, spectra, dir = ".", cmps = NULL, metad = NULL)
Arguments
- file
File where spectra will be exported. Can be '.mgf' or '.sqlite'
- spectra
The spectra object where spectra are stored
- dir
Directory for export
- cmps
Optional. Compounds data frame as in 'CompoundDb' package
- metad
Optional. Metadata as in 'CompoundDb' package