食品科学 ›› 2024, Vol. 45 ›› Issue (20): 256-262.doi: 10.7506/spkx1002-6630-20240401-002

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基于三维荧光光谱耦合平行因子法的菊花特征组分快速无损鉴别

陈思雨, 裴颍, 顾海洋   

  1. (1.安徽大学生命科学学院,安徽 合肥 230000;2.滁州学院生物与食品工程学院,安徽 滁州 239000)
  • 出版日期:2024-10-25 发布日期:2024-10-14
  • 基金资助:
    国家自然科学基金青年科学基金项目(31701685);安徽省教育厅重点项目(2023AH051612)

Rapid and Non-destructive Identification of Characteristic Components of Chrysanthemum by Three-Dimensional Excitation Emission Matrix Spectroscopy Coupled with Parallel Factor Analysis

CHEN Siyu, PEI Ying, GU Haiyang   

  1. (1. School of Life Sciences, Anhui University, Hefei 230000, China;2. School of Biological Science and Food Engineering, Chuzhou University, Chuzhou 239000, China)
  • Online:2024-10-25 Published:2024-10-14

摘要: 为提高菊花特征组分的检测效率,提出一种基于三维荧光光谱(three-dimensional excitation emission matrix spectroscopy,3DEEM)耦合平行因子分析(parallel factor analysis,PARAFAC)的快速鉴别方法。以4 种菊花为研究对象,在分别获取样品3DEEM矩阵(EEMs)后,首先通过数据预处理去除如拉曼散射和瑞利散射等干扰数据,并剔除异常值,分析光谱特征。然后,采用PARAFAC进行特征提取,通过方差解释率和残差分析法,确定菊花两种特征荧光组分为氨基酸和黄酮类化合物。最后利用支持向量机(support vector machines,SVM)和BP神经网络(back propagation neural network,BPNN)对特征变量进行分析,建立菊花快速无损鉴别模型。SVM和BPNN训练集结果分别为100%、95.93%,测试集结果分别为94.50%、89.61%。结果表明,3DEEM-PARAFAC结合SVM可以实现对菊花特征组分的定性定量分析,能够对菊花进行快速鉴别。

关键词: 菊花;三维荧光光谱;特征组分鉴别;平行因子分析;支持向量机;BP神经网络

Abstract: A fast method for the identification of the characteristic components of Chrysanthemum was proposed using three-dimensional excitation emission matrix (3DEEM) spectroscopy coupled with parallel factor analysis (PARAFAC). The 3DEEM spectra of four varieties of Chrysanthemum were obtained and preprocessed to remove interference data such as Raman and Rayleigh scattering as well as outliers, and the spectral characteristics were analyzed. Feature extraction was then performed using PARAFAC, and amino acids and flavonoids were identified as characteristic fluorescent components of Chrysanthemum based on variance interpretation rate and residual analysis. Finally, support vector machine (SVM) and back propagation neural network (BPNN) were employed to analyze the characteristic variables and a fast and non-destructive identification model was developed. The accuracy of the SVM and BPNN models were 100% and 95.93% for the training set, and 94.50% and 89.61% for the test set, respectively. This study demonstrates that 3DEEM-PARAFAC combined with SVM enables both qualitative and quantitative analysis of Chrysanthemum’s characteristic components and rapid identification of Chrysanthemum.

Key words: Chrysanthemum; three-dimensional excitation emission matrix spectroscopy; characteristic component identification; parallel factor analysis; support vector machine; back propagation neural network

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