拉曼光谱
主成分分析
人工智能
食用油
化学计量学
色谱法
化学
光谱学
模式识别(心理学)
生物系统
气相色谱法
机器学习
分析化学(期刊)
计算机科学
食品科学
物理
生物
光学
量子力学
作者
Hefei Zhao,Yinglun Zhan,Zheng Xu,Joshua Nduwamungu,Yuzhen Zhou,Robert Powers,Changmou Xu
出处
期刊:Food Chemistry
[Elsevier]
日期:2021-10-27
卷期号:373: 131471-131471
被引量:58
标识
DOI:10.1016/j.foodchem.2021.131471
摘要
Raman spectroscopy is an emerging technique for the rapid detection of oil qualities. But the spectral analysis is time-consuming and low-throughput, which has limited the broad adoption. To address this issue, nine supervised machine learning (ML) algorithms were integrated into a Raman spectroscopy protocol for achieving the rapid analysis. Raman spectra were obtained for ten commercial edible oils from a variety of brands and the resulting spectral dataset was analyzed with supervised ML algorithms and compared against a principal component analysis (PCA) model. A ML-derived model obtained an accuracy of 96.7% in detecting oil type and an adulteration prediction of 0.984 (R2). Several ML algorithms also were superior than PCA in classifying edible oils based on fatty acid compositions by gas chromatography, with a faster readout and 100% accuracy. This study provided an exemplar for combining conventional Raman spectroscopy or gas chromatography with ML for the rapid food analysis.
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