Convert `PlotFTIR` data to `ir`

Source: R/io.R

Converts `PlotFTIR` data to that ready to use by the `ir` package.

Convertit les données `PlotFTIR` en données prêtes à être utilisées par le paquet `ir`.

plotftir_to_ir(ftir, metadata = NULL)

Arguments

ftir

A data.frame in long format with columns `sample_id`, `wavenumber`, and `absorbance`/`transmittance`. Un data.frame au format long avec les colonnes `sample_id`, `wavenumber`, et `absorbance`/`transmittance`.

metadata

Additional data to pass to `ir` to include as metadata. Should be structured as a data.frame.

Données supplémentaires à transmettre à `ir` pour les inclure dans les métadonnées. Doit être structuré comme un data.frame.

Value

an `ir` classed data.frame structured for use in that package.

un data.frame de classe `ir` structuré pour être utilisé dans ce paquet.

See also

[ir::ir_new_ir()] for information on how ir takes in data.

Examples

if (requireNamespace("ir", quietly = TRUE)) {
  # convert biodiesel to a `ir` object
  plotftir_to_ir(biodiesel,
    metadata = data.frame("Biodiesel_Content" = c(0, 0.25, 0.5, 1, 2.5, 5, 7.5, 10, 0.5, 5, NA))
  )
}
#>    Biodiesel_Content      id_sample
#> 1               0.00    biodiesel_0
#> 2               0.25 biodiesel_0_25
#> 3               0.50 biodiesel_0_50
#> 4               1.00  biodiesel_1_0
#> 5               2.50  biodiesel_2_5
#> 6               5.00  biodiesel_5_0
#> 7               7.50  biodiesel_7_5
#> 8              10.00 biodiesel_10_0
#> 9               0.50 biodiesel_B0_5
#> 10              5.00   biodiesel_B5
#> 11                NA diesel_unknown
#>                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                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