用手持式近红外光谱仪和机器学习快速鉴定陈皮贮藏期

IF 1.6 4区 化学 Q3 CHEMISTRY, APPLIED
Xin Zhang, Zhangming Gao, Y. Yang, Shaowei Pan, Jianwei Yin, Xiangyang Yu
{"title":"用手持式近红外光谱仪和机器学习快速鉴定陈皮贮藏期","authors":"Xin Zhang, Zhangming Gao, Y. Yang, Shaowei Pan, Jianwei Yin, Xiangyang Yu","doi":"10.1177/09670335211057232","DOIUrl":null,"url":null,"abstract":"Dried tangerine peel is a Chinese medicine with high medicinal value. The storage age is an important indicator of its medicinal value, so it is very significant to accurately identify the storage age of dried tangerine peel. Traditional physical and chemical analysis methods can be used to achieve this goal, but these methods are limited by their operability and convenience. Near infrared (NIR) spectroscopy and machine learning have excellent performance in the rapid detection of food and pharmaceutical samples. This study investigated the novel application of integrating a hand-held NIR spectrometer combined with machine learning to rapidly and accurately identify the storage age of Xinhui dried tangerine peel. Savitzky–Golay convolution smoothing, standard normal variate (SNV), first derivative, and second derivative pretreatments were employed to preprocess spectral data. Principal component analysis (PCA) was used to reduce the spectral data dimensions and obtain the characteristic spectral variables of each sample. Support vector machine (SVM) and k-nearest neighbor were applied to establish the qualitative discriminant models. The SNV-PCA-SVM model discriminant accuracy was 99.60% in the validation set and was 96.50% in the test set, showing excellent generalization performance. The results indicated that the method of using a hand-held NIR spectrometer combined with machine learning could be applied to rapidly identify the storage age of Xinhui dried tangerine peel. This is a promising and economical hand-held NIR spectroscopic method for assuring the dried tangerine peel age on-site.","PeriodicalId":16551,"journal":{"name":"Journal of Near Infrared Spectroscopy","volume":"30 1","pages":"31 - 39"},"PeriodicalIF":1.6000,"publicationDate":"2022-01-18","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"5","resultStr":"{\"title\":\"Rapid identification of the storage age of dried tangerine peel using a hand-held near infrared spectrometer and machine learning\",\"authors\":\"Xin Zhang, Zhangming Gao, Y. Yang, Shaowei Pan, Jianwei Yin, Xiangyang Yu\",\"doi\":\"10.1177/09670335211057232\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"Dried tangerine peel is a Chinese medicine with high medicinal value. The storage age is an important indicator of its medicinal value, so it is very significant to accurately identify the storage age of dried tangerine peel. Traditional physical and chemical analysis methods can be used to achieve this goal, but these methods are limited by their operability and convenience. Near infrared (NIR) spectroscopy and machine learning have excellent performance in the rapid detection of food and pharmaceutical samples. This study investigated the novel application of integrating a hand-held NIR spectrometer combined with machine learning to rapidly and accurately identify the storage age of Xinhui dried tangerine peel. Savitzky–Golay convolution smoothing, standard normal variate (SNV), first derivative, and second derivative pretreatments were employed to preprocess spectral data. Principal component analysis (PCA) was used to reduce the spectral data dimensions and obtain the characteristic spectral variables of each sample. Support vector machine (SVM) and k-nearest neighbor were applied to establish the qualitative discriminant models. The SNV-PCA-SVM model discriminant accuracy was 99.60% in the validation set and was 96.50% in the test set, showing excellent generalization performance. The results indicated that the method of using a hand-held NIR spectrometer combined with machine learning could be applied to rapidly identify the storage age of Xinhui dried tangerine peel. This is a promising and economical hand-held NIR spectroscopic method for assuring the dried tangerine peel age on-site.\",\"PeriodicalId\":16551,\"journal\":{\"name\":\"Journal of Near Infrared Spectroscopy\",\"volume\":\"30 1\",\"pages\":\"31 - 39\"},\"PeriodicalIF\":1.6000,\"publicationDate\":\"2022-01-18\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"5\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of Near Infrared Spectroscopy\",\"FirstCategoryId\":\"92\",\"ListUrlMain\":\"https://doi.org/10.1177/09670335211057232\",\"RegionNum\":4,\"RegionCategory\":\"化学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q3\",\"JCRName\":\"CHEMISTRY, APPLIED\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Near Infrared Spectroscopy","FirstCategoryId":"92","ListUrlMain":"https://doi.org/10.1177/09670335211057232","RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"CHEMISTRY, APPLIED","Score":null,"Total":0}
引用次数: 5

摘要

陈皮是一种具有很高药用价值的中药。陈皮贮藏年限是衡量其药用价值的重要指标,因此准确鉴定陈皮的贮藏年限具有重要意义。传统的物理和化学分析方法可以用来实现这一目标,但这些方法的可操作性和便利性有限。近红外光谱和机器学习在食品和药品样品的快速检测中具有优异的性能。本研究研究研究了将手持近红外光谱仪与机器学习相结合的新应用,以快速准确地识别新会陈皮的储存年龄。Savitzky–Golay卷积平滑、标准正态变量(SNV)、一阶导数和二阶导数预处理用于对光谱数据进行预处理。主成分分析(PCA)用于降低光谱数据的维数,并获得每个样本的特征光谱变量。应用支持向量机(SVM)和k近邻建立定性判别模型。SNV-PCA-SVM模型的判别准确率在验证集中为99.60%,在测试集中为96.50%,表现出优异的泛化性能。结果表明,手持近红外光谱仪与机器学习相结合的方法可以快速识别新会陈皮的贮藏年龄。这是一种很有前途且经济的手持式近红外光谱方法,可用于确保陈皮的现场老化。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Rapid identification of the storage age of dried tangerine peel using a hand-held near infrared spectrometer and machine learning
Dried tangerine peel is a Chinese medicine with high medicinal value. The storage age is an important indicator of its medicinal value, so it is very significant to accurately identify the storage age of dried tangerine peel. Traditional physical and chemical analysis methods can be used to achieve this goal, but these methods are limited by their operability and convenience. Near infrared (NIR) spectroscopy and machine learning have excellent performance in the rapid detection of food and pharmaceutical samples. This study investigated the novel application of integrating a hand-held NIR spectrometer combined with machine learning to rapidly and accurately identify the storage age of Xinhui dried tangerine peel. Savitzky–Golay convolution smoothing, standard normal variate (SNV), first derivative, and second derivative pretreatments were employed to preprocess spectral data. Principal component analysis (PCA) was used to reduce the spectral data dimensions and obtain the characteristic spectral variables of each sample. Support vector machine (SVM) and k-nearest neighbor were applied to establish the qualitative discriminant models. The SNV-PCA-SVM model discriminant accuracy was 99.60% in the validation set and was 96.50% in the test set, showing excellent generalization performance. The results indicated that the method of using a hand-held NIR spectrometer combined with machine learning could be applied to rapidly identify the storage age of Xinhui dried tangerine peel. This is a promising and economical hand-held NIR spectroscopic method for assuring the dried tangerine peel age on-site.
求助全文
通过发布文献求助,成功后即可免费获取论文全文。 去求助
来源期刊
CiteScore
3.30
自引率
5.60%
发文量
35
审稿时长
6 months
期刊介绍: JNIRS — Journal of Near Infrared Spectroscopy is a peer reviewed journal, publishing original research papers, short communications, review articles and letters concerned with near infrared spectroscopy and technology, its application, new instrumentation and the use of chemometric and data handling techniques within NIR.
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
确定
请完成安全验证×
copy
已复制链接
快去分享给好友吧!
我知道了
右上角分享
点击右上角分享
0
联系我们:info@booksci.cn Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。 Copyright © 2023 布克学术 All rights reserved.
京ICP备2023020795号-1
ghs 京公网安备 11010802042870号
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术官方微信