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Covers the workflow from    raw spectra to calibrated results: peak finding and fitting, wavelength    calibration, baseline correction, normalization and scaling, orthogonal    signal correction including orthogonal partial least squares (OPLS;    Trygg and Wold (2002) <doi:10.1002/cem.695>), calibration transfer,    calibration curves and figures of merit, and plasma diagnostics    (Boltzmann and Saha-Boltzmann plots, Stark broadening). Includes robust    tools for outlier detection and exploration: robust principal component    analysis (Hubert, Rousseeuw and Vanden Branden (2005)    <doi:10.1198/004017004000000563>), detection of deviating cells    (Rousseeuw and Van den Bossche (2018)    <doi:10.1080/00401706.2017.1340909>), PCA with cellwise outliers and    missing values (MacroPCA; Hubert, Rousseeuw and Van den Bossche (2019)    <doi:10.1080/00401706.2018.1562989>), robust transformations to central    normality (Raymaekers and Rousseeuw (2021)    <doi:10.1007/s10994-021-05960-5>), and self-organizing maps (Kohonen    (1982) <doi:10.1007/BF00337288>). Preprocessing steps are also available    as 'recipes' steps for 'tidymodels' workflows. 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