Quantifying binary and ternary mixtures of monovarietal extra virgin olive oils with UV-vis absorption and chemometrics

被引:11
作者
Aroca-Santos, Regina [1 ]
Cancilla, John C. [1 ]
Perez-Perez, Ana [1 ]
Moral, Ana [2 ]
Torrecilla, Jose S. [1 ]
机构
[1] Univ Complutense Madrid, Fac Ciencias Quim, Dept Ingn Quim, E-28040 Madrid, Spain
[2] Univ Pablo de Olavide, Area Ingn Quim, Dept Biol Mol & Ingn Bioquim, Carretera Utrera,Km 1, Seville 41013, Spain
关键词
Extra virgin olive oil; Pigments; Linear regression; Artificial neural networks; ARTIFICIAL NEURAL-NETWORKS; IONIC LIQUIDS; IMIDAZOLIUM; SPECTRA; MODELS; BLENDS; ORIGIN;
D O I
10.1016/j.snb.2016.04.094
中图分类号
O65 [分析化学];
学科分类号
070302 ; 081704 ;
摘要
The pigment profile of three monovarietal extra virgin olive oils (EVOOs) (Cornicabra, Picual, and Hojiblanca varietals) and their binary and ternary mixtures have been analyzed through visible spectroscopy. The information extracted from the registered spectra was treated and then modeled following two different chemometric approaches: a linear one based on multiple linear regression models, and a non-linear one based on the employment of artificial neural networks. All the designed models were validated using a k-fold cross-validation, and the largest mean absolute errors (MAEs) obtained for the varietal quantifications were 10% for the linear model and 2.8% for the non-linear one. These results let us prove the efficient generalization capability of these mathematical tools, as they are able to accurately quantify olive oil varietals in mixtures through their pigment profile only requiring visible spectroscopy data. (C) 2016 Elsevier B.V. All rights reserved.
引用
收藏
页码:115 / 121
页数:7
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