利用 SERS 结合机器/深度学习快速检测昆布茶发酵过程中的 l-茶氨酸的方法

IF 4.9 2区 化学 Q1 CHEMISTRY, ANALYTICAL Microchemical Journal Pub Date : 2024-09-03 DOI:10.1016/j.microc.2024.111557
Songguang Zhao, Tianhui Jiao, Selorm Yao-Say Solomon Adade, Zhen Wang, Xiaoxiao Wu, Qin Ouyang, Quansheng Chen
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引用次数: 0

摘要

在发酵过程中快速检测关键指标对提高产品质量至关重要。有鉴于此,研究人员开发了一种利用表面增强拉曼散射(SERS)结合机器/深度学习方法快速检测昆布茶发酵过程中-茶氨酸的策略。在分析了-茶氨酸 SERS 特征峰的归因后,提取了有效的变量特征、转换特征和深度特征,并利用偏最小二乘法(PLS)、支持向量机(SVM)和一维卷积神经网络(1DCNN)构建了校准模型。基于通过主成分分析(PCA)得出的前 10 个主成分,所建立的 PCA10-1DCNN 模型显示出卓越的性能,其判定系数(R)为 0.9750。PCA10-1DCNN 的验证效果值得称赞,最大误差为 4.4460 µg/mL,这表明该策略在-茶氨酸快速检测中的有效性。这项研究为茶饮料生产中的茶氨酸快速检测提供了一种可行的策略。
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A rapid method for detecting l-Theanine during kombucha fermentation using SERS combined with machine/deep learning
The rapid detection of key indicators during the fermentation is crucial for improving product quality. In light of this, a strategy was developed for the rapid detection of -Theanine during kombucha fermentation using surface-enhanced Raman Scattering (SERS) coupled with machine/deep learning methodologies. After analyzing the attribution of -Theanine SERS characteristic peaks, effective variable features, converted features, and depth features were extracted, and calibration models were constructed employing Partial Least Squares (PLS), Support Vector Machine (SVM), and a one-dimensional Convolutional Neural Network (1DCNN). Based on the first 10 principal components derived via principal component analysis (PCA), the established model, PCA10-1DCNN, displayed superior performance with a determination coefficient (R) of 0.9750. PCA10-1DCNN achieved commendable verification efficacy, with a maximum error of 4.4460 µg/mL, indicating the efficacy of this strategy for the -Theanine rapid detection. This study offers a viable strategy for the -Theanine rapid detection in the production of tea-based beverages.
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来源期刊
Microchemical Journal
Microchemical Journal 化学-分析化学
CiteScore
8.70
自引率
8.30%
发文量
1131
审稿时长
1.9 months
期刊介绍: The Microchemical Journal is a peer reviewed journal devoted to all aspects and phases of analytical chemistry and chemical analysis. The Microchemical Journal publishes articles which are at the forefront of modern analytical chemistry and cover innovations in the techniques to the finest possible limits. This includes fundamental aspects, instrumentation, new developments, innovative and novel methods and applications including environmental and clinical field. Traditional classical analytical methods such as spectrophotometry and titrimetry as well as established instrumentation methods such as flame and graphite furnace atomic absorption spectrometry, gas chromatography, and modified glassy or carbon electrode electrochemical methods will be considered, provided they show significant improvements and novelty compared to the established methods.
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