Detection of Aflatoxin B_1 in Peanut Oil Using Attenuated Total Reflection Fourier Transform Infrared Spectroscopy Combined with Partial Least Squares Discriminant Analysis and Support Vector Machine Models

摘要

This study was conducted to establish a rapid and accurate method for identifying aflatoxin contamination in peanut oil. Attenuated total reflection Fourier transform infrared (ATR-FTIR) spectroscopy combined with either partial least squares discriminant analysis (PLS-DA) or a support vector machine (SVM) algorithm were used to construct discriminative models for distinguishing between uncontaminated and aflatoxin-contaminated peanut oil. Peanut oil samples containing various concentrations of aflatoxin B_1 were examined with an ATR-FTIR spectrometer. Preprocessed spectral data were input to PLS-DA and SVM algorithms to construct discriminative models for aflatoxin contamination in peanut oil. SVM penalty and kernel function parameters were optimized using grid search, a genetic algorithm, and particle swarm optimization. The PLS-DA model established using spectral data had an accuracy of 94.64% and better discrimination than did models established based on preprocessed data. The SVM model established after data normalization and grid search optimization with a penalty parameter of 16 and a kernel function parameter of 0.0359 had the best discrimination, with 98.2143% accuracy. The discriminative models for aflatoxin contamination in peanut oil established by combining ATR-FTIR spectral data and nonlinear SVM algorithm were superior to the linear PLS-DA models.