Articles producció científica> Química Analítica i Química Orgànica

FT-Raman and NIR spectroscopy data fusion strategy for multivariate qualitative analysis of food fraud

  • Datos identificativos

    Identificador: PC:1902
    Autores:
    M .Isabel LópezCristina MárquezItziar RuisánchezM. Pilar Callao
    Resumen:
    Two data fusion strategies (high- and mid-level) combined with a multivariate classification approach (Soft Independent Modelling of Class Analogy, SIMCA) have been applied to take advantage of the synergistic effect of the information obtained from two spectroscopic techniques: FT-Raman and NIR. Mid-level data fusion consists of merging some of the previous selected variables from the spectra obtained from each spectroscopic technique and then applying the classification technique. High-level data fusion combines the SIMCA classification results obtained individually from each spectroscopic technique. Of the possible ways to make the necessary combinations, we decided to use fuzzy aggregation connective operators. As a case study, we considered the possible adulteration of hazelnut paste with almond. Using the two-class SIMCA approach, class 1 consisted of unadulterated hazelnut samples and class 2 of samples adulterated with almond. Models performance was also studied with samples adulterated with chickpea. The results show that data fusion is an effective strategy since the performance parameters are better than the individual ones: sensitivity and specificity values between 75% and 100% for the individual techniques and between 96–100% and 88–100% for the mid- and high-level data fusion strategies, respectively.
  • Otros:

    Autor según el artículo: M .Isabel López; Cristina Márquez; Itziar Ruisánchez; M. Pilar Callao
    Departamento: Química Analítica i Química Orgànica
    Autor/es de la URV: LÓPEZ VILARDELL, MARIA ISABEL; Cristina Márquez; RUISANCHEZ CAPELASTEGUI, MARÍA ICIAR; CALLAO LASMARIAS, MARÍA PILAR
    Palabras clave: FT-Raman Food adulteration NIR
    Resumen: Two data fusion strategies (high- and mid-level) combined with a multivariate classification approach (Soft Independent Modelling of Class Analogy, SIMCA) have been applied to take advantage of the synergistic effect of the information obtained from two spectroscopic techniques: FT-Raman and NIR. Mid-level data fusion consists of merging some of the previous selected variables from the spectra obtained from each spectroscopic technique and then applying the classification technique. High-level data fusion combines the SIMCA classification results obtained individually from each spectroscopic technique. Of the possible ways to make the necessary combinations, we decided to use fuzzy aggregation connective operators. As a case study, we considered the possible adulteration of hazelnut paste with almond. Using the two-class SIMCA approach, class 1 consisted of unadulterated hazelnut samples and class 2 of samples adulterated with almond. Models performance was also studied with samples adulterated with chickpea. The results show that data fusion is an effective strategy since the performance parameters are better than the individual ones: sensitivity and specificity values between 75% and 100% for the individual techniques and between 96–100% and 88–100% for the mid- and high-level data fusion strategies, respectively.
    Grupo de investigación: Grup de Quimiometria, Qualimetria i Nanosensors
    Áreas temáticas: Chemistry Química Química
    Acceso a la licencia de uso: https://creativecommons.org/licenses/by/3.0/es/
    ISSN: 0039-9140
    Identificador del autor: n/a; n/a; 0000-0002-7097-3583; 0000-0003-2691-329X
    Fecha de alta del registro: 2016-09-21
    Página final: 86
    Volumen de revista: 161
    Versión del articulo depositado: info:eu-repo/semantics/acceptedVersion
    Enlace a la fuente original: https://www.sciencedirect.com/science/article/abs/pii/S0039914016305732?via%3Dihub
    URL Documento de licencia: https://repositori.urv.cat/ca/proteccio-de-dades/
    DOI del artículo: 10.1016/j.talanta.2016.08.003
    Entidad: Universitat Rovira i Virgili
    Año de publicación de la revista: 2016
    Página inicial: 80
    Tipo de publicación: Article Artículo Article
  • Palabras clave:

    Avellanes -- Adulteració i inspecció
    Espectroscòpia infraroja pròxima
    Espectroscòpia Raman
    FT-Raman
    Food adulteration
    NIR
    Chemistry
    Química
    Química
    0039-9140
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