Rapid Identification and Quality Evaluation of Medicinal Centipedes in China Using Near-Infrared Spectroscopy Integrated with Support Vector Machine Algorithm

To investigate the feasibility of rapid identification and quality evaluation of Chinese medicinal centipedes using NIR spectroscopy, the qualitative and quantitative analysis models were explored. A PCA-SVC model was optimized to differentiate five species of the genus Scolopendra. When the model w...

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Main Authors: Sihe Kang, Haiying Deng, Long Chen, Xiaoxuan Zeng, Yimei Liu, Keli Chen
Format: Article
Language:English
Published: Wiley 2019-01-01
Series:Journal of Spectroscopy
Online Access:http://dx.doi.org/10.1155/2019/9636823
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author Sihe Kang
Haiying Deng
Long Chen
Xiaoxuan Zeng
Yimei Liu
Keli Chen
author_facet Sihe Kang
Haiying Deng
Long Chen
Xiaoxuan Zeng
Yimei Liu
Keli Chen
author_sort Sihe Kang
collection DOAJ
description To investigate the feasibility of rapid identification and quality evaluation of Chinese medicinal centipedes using NIR spectroscopy, the qualitative and quantitative analysis models were explored. A PCA-SVC model was optimized to differentiate five species of the genus Scolopendra. When the model was validated with the calibration and prediction sets, the prediction accuracy was 100% and 81.82%, respectively; it can meet the requirement for rapid and preliminary identification. Based on nitrogen content detected by the chemical method, and the dimensionality of spectral data reduced with PLS, the quantitative analysis models were successfully built by PLSR and SVR algorithms. After spectra were pretreated and parameters were optimized, the performance, rationality, and prediction ability of the models were validated and evaluated with RMSECV, RMSEP, RMSEE, R2, and RPD. Compared with the features and advantages of these two models, the PLS-SVR model had better performance and stronger prediction capacity, and it was finally regarded as the optimal quantitative analysis model to predict nitrogen content. The relative deviation between the predictive value and the reference was 2.69%, and the average recovery was 99.02%, which indicated it has potential for rapid prediction and evaluation of the quality of medicinal centipedes. This research suggested that NIR spectroscopy can be used as a rapid detection method to identify species and evaluate the quality of medicinal centipedes in China.
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publishDate 2019-01-01
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series Journal of Spectroscopy
spelling doaj-art-4316fd2de21249d3a822d7c8dfb1c28b2025-02-03T06:11:01ZengWileyJournal of Spectroscopy2314-49202314-49392019-01-01201910.1155/2019/96368239636823Rapid Identification and Quality Evaluation of Medicinal Centipedes in China Using Near-Infrared Spectroscopy Integrated with Support Vector Machine AlgorithmSihe Kang0Haiying Deng1Long Chen2Xiaoxuan Zeng3Yimei Liu4Keli Chen5Key Laboratory of Ministry of Education on Traditional Chinese Medicine Resource and Compound Prescription, Hubei University of Chinese Medicine, Wuhan 430065, ChinaMedical College of Wuhan University of Science and Technology, Hubei Province Key Laboratory of Occupational Hazard Identification and Control, Wuhan 430065, ChinaKey Laboratory of Ministry of Education on Traditional Chinese Medicine Resource and Compound Prescription, Hubei University of Chinese Medicine, Wuhan 430065, ChinaKey Laboratory of Ministry of Education on Traditional Chinese Medicine Resource and Compound Prescription, Hubei University of Chinese Medicine, Wuhan 430065, ChinaKey Laboratory of Ministry of Education on Traditional Chinese Medicine Resource and Compound Prescription, Hubei University of Chinese Medicine, Wuhan 430065, ChinaKey Laboratory of Ministry of Education on Traditional Chinese Medicine Resource and Compound Prescription, Hubei University of Chinese Medicine, Wuhan 430065, ChinaTo investigate the feasibility of rapid identification and quality evaluation of Chinese medicinal centipedes using NIR spectroscopy, the qualitative and quantitative analysis models were explored. A PCA-SVC model was optimized to differentiate five species of the genus Scolopendra. When the model was validated with the calibration and prediction sets, the prediction accuracy was 100% and 81.82%, respectively; it can meet the requirement for rapid and preliminary identification. Based on nitrogen content detected by the chemical method, and the dimensionality of spectral data reduced with PLS, the quantitative analysis models were successfully built by PLSR and SVR algorithms. After spectra were pretreated and parameters were optimized, the performance, rationality, and prediction ability of the models were validated and evaluated with RMSECV, RMSEP, RMSEE, R2, and RPD. Compared with the features and advantages of these two models, the PLS-SVR model had better performance and stronger prediction capacity, and it was finally regarded as the optimal quantitative analysis model to predict nitrogen content. The relative deviation between the predictive value and the reference was 2.69%, and the average recovery was 99.02%, which indicated it has potential for rapid prediction and evaluation of the quality of medicinal centipedes. This research suggested that NIR spectroscopy can be used as a rapid detection method to identify species and evaluate the quality of medicinal centipedes in China.http://dx.doi.org/10.1155/2019/9636823
spellingShingle Sihe Kang
Haiying Deng
Long Chen
Xiaoxuan Zeng
Yimei Liu
Keli Chen
Rapid Identification and Quality Evaluation of Medicinal Centipedes in China Using Near-Infrared Spectroscopy Integrated with Support Vector Machine Algorithm
Journal of Spectroscopy
title Rapid Identification and Quality Evaluation of Medicinal Centipedes in China Using Near-Infrared Spectroscopy Integrated with Support Vector Machine Algorithm
title_full Rapid Identification and Quality Evaluation of Medicinal Centipedes in China Using Near-Infrared Spectroscopy Integrated with Support Vector Machine Algorithm
title_fullStr Rapid Identification and Quality Evaluation of Medicinal Centipedes in China Using Near-Infrared Spectroscopy Integrated with Support Vector Machine Algorithm
title_full_unstemmed Rapid Identification and Quality Evaluation of Medicinal Centipedes in China Using Near-Infrared Spectroscopy Integrated with Support Vector Machine Algorithm
title_short Rapid Identification and Quality Evaluation of Medicinal Centipedes in China Using Near-Infrared Spectroscopy Integrated with Support Vector Machine Algorithm
title_sort rapid identification and quality evaluation of medicinal centipedes in china using near infrared spectroscopy integrated with support vector machine algorithm
url http://dx.doi.org/10.1155/2019/9636823
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