1. Significance of variables for discrimination: Applied to the search of organic ions in mass spectra measured on cometary particles
- Author
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Varmuza, Kurt, Filzmoser, Peter, Hoffmann, Irene, Walach, Jan, Cottin, Hervé, Fray, Nicolas, Briois, Christelle, Modica, Paola, Bardyn, Anaïs, Silén, Johan, Siljeström, Sandra, Stenzel, Oliver, Kissel, Jochen, Hilchenbach, Martin, Institute of Statistics and Mathematical Methods in Economics, Laboratoire Interuniversitaire des Systèmes Atmosphériques (LISA (UMR_7583)), Institut national des sciences de l'Univers (INSU - CNRS)-Université Paris Diderot - Paris 7 (UPD7)-Université Paris-Est Créteil Val-de-Marne - Paris 12 (UPEC UP12)-Centre National de la Recherche Scientifique (CNRS), Laboratoire de Physique et Chimie de l'Environnement et de l'Espace (LPC2E), Observatoire des Sciences de l'Univers en région Centre (OSUC), Institut national des sciences de l'Univers (INSU - CNRS)-Observatoire de Paris, Université Paris sciences et lettres (PSL)-Université Paris sciences et lettres (PSL)-Université d'Orléans (UO)-Centre National de la Recherche Scientifique (CNRS)-Institut national des sciences de l'Univers (INSU - CNRS)-Observatoire de Paris, Université Paris sciences et lettres (PSL)-Université Paris sciences et lettres (PSL)-Université d'Orléans (UO)-Centre National de la Recherche Scientifique (CNRS)-Centre National d’Études Spatiales [Paris] (CNES), Institut d'astrophysique spatiale (IAS), Université Paris-Sud - Paris 11 (UP11)-Institut national des sciences de l'Univers (INSU - CNRS)-Centre National de la Recherche Scientifique (CNRS), Finnish Meteorological Institute (FMI), Department of Chemistry, Materials and Surfaces [Boras], SP Technical Research Institute of Sweden, Max-Planck-Institut für Sonnensystemforschung (MPS), Max-Planck-Gesellschaft, Université Paris-Est Créteil Val-de-Marne - Paris 12 (UPEC UP12)-Institut national des sciences de l'Univers (INSU - CNRS)-Université Paris Diderot - Paris 7 (UPD7)-Centre National de la Recherche Scientifique (CNRS), Institut national des sciences de l'Univers (INSU - CNRS)-Centre National de la Recherche Scientifique (CNRS)-Université d'Orléans (UO)-Observatoire de Paris, PSL Research University (PSL)-PSL Research University (PSL)-Institut national des sciences de l'Univers (INSU - CNRS)-Centre National de la Recherche Scientifique (CNRS)-Université d'Orléans (UO)-Observatoire de Paris, and PSL Research University (PSL)-PSL Research University (PSL)-Centre National d’Études Spatiales [Paris] (CNES)
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time-of-flight secondary ion mass spectrometry ,[SDU]Sciences of the Universe [physics] ,Rosetta ,variable importance ,classificationcomet 67P/Churyumov-Gerasimenko ,random forest ,D-PL ,Spairwise log ratios - Abstract
International audience; The instrument Cometary Secondary Ion Mass Analyzer (COSIMA) on board of the European Space Agency mission Rosetta to the comet 67P/Churyumov-Gerasimenko is a secondary ion mass spectrometer with a time-of-flight mass analyzer. It collected near the comet several thousand particles, imaged them, and analyzed the elemental and chemical compositions of their surfaces. In this study, variables have been generated from the spectral data covering the mass ranges of potential C-, H-, N-, and O-containing ions. The variable importance in binary discriminations between spectra measured on cometary particles and those measured on the target background has been estimated by the univariate t test and the multivariate methods discriminant partial least squares, random forest, and a robust method based on the log ratios of all variable pairs. The results confirm the presence of organic substances in cometary matter—probably a complex macromolecular mixture.
- Published
- 2018
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