Sanitize spectra — sanitize_spectra • tima

This function sanitizes spectra

Usage

sanitize_spectra(
  spectra,
  cutoff = 0,
  dalton = 0.01,
  polarity = NA,
  ppm = 10,
  combine = TRUE
)

Arguments

spectra: Spectra object
cutoff: Absolute minimal intensity
dalton: Dalton tolerance
polarity: Polarity
ppm: PPM tolerance
combine: Flag indicating whether to combine Default TRUE

Value

The sanitized spectra

Examples

if (FALSE) { # \dontrun{
data.frame(
  FEATURE_ID = c("FT001", "FT002", "FT003"),
  mz = c(list(123.4567, 234.5678, 345.6789))
) |>
  Spectra::Spectra() |>
  sanitize_spectra()
} # }