利用近红外超光谱成像技术解决牛至干叶掺假问题

IF 3.7 2区 化学 Q2 AUTOMATION & CONTROL SYSTEMS Chemometrics and Intelligent Laboratory Systems Pub Date : 2024-04-23 DOI:10.1016/j.chemolab.2024.105133
Veronica Ferrari , Rosalba Calvini , Camilla Menozzi , Alessandro Ulrici , Marco Bragolusi , Roberto Piro , Alessandra Tata , Michele Suman , Giorgia Foca
{"title":"利用近红外超光谱成像技术解决牛至干叶掺假问题","authors":"Veronica Ferrari ,&nbsp;Rosalba Calvini ,&nbsp;Camilla Menozzi ,&nbsp;Alessandro Ulrici ,&nbsp;Marco Bragolusi ,&nbsp;Roberto Piro ,&nbsp;Alessandra Tata ,&nbsp;Michele Suman ,&nbsp;Giorgia Foca","doi":"10.1016/j.chemolab.2024.105133","DOIUrl":null,"url":null,"abstract":"<div><p>Dried oregano leaves are particularly prone to adulteration because of their widespread distribution and their easy mixing with leaves of other plants of lower commercial value, such as olive, myrtle, strawberry tree, or sumac. To reveal the presence of adulteration, in this study we considered an untargeted analytical approach, which instead of involving the <em>a priori</em> selection of specific compounds of interest is focused on defining the characteristic spectral signature of authentic oregano with respect to its most frequent adulterants. NIR HyperSpectral Imaging (NIR-HSI) represents a state-of-the-art, rapid and non-destructive technique, allowing for the collection of both spectral and spatial information from the sample, making it particularly suitable for characterizing visually heterogeneous samples.</p><p>Authentication issues are typically assessed through class modelling techniques and Soft Independent Modelling of class Analogy (SIMCA) is one of the most used algorithms in this scenario. However, the high variability and heterogeneity within the authentic oregano class resulted in poor outcomes when SIMCA was applied. As an alternative, Soft Partial Least Squares Discriminant Analysis (Soft PLS-DA) algorithm was applied to differentiate authentic oregano samples from pure adulterants. Soft PLS-DA represents a hybrid approach that combines the advantages of both discriminant and class modelling techniques. The resultant classification model has indeed led to promising results, achieving a prediction efficiency of 92.9 %. Finally, based on the percentage of pixels predicted as oregano in the Soft-PLSDA prediction images, a threshold value of 10 % was established, serving as a detection limit of NIR-HSI to distinguish authentic oregano samples from adulterated ones.</p></div>","PeriodicalId":9774,"journal":{"name":"Chemometrics and Intelligent Laboratory Systems","volume":null,"pages":null},"PeriodicalIF":3.7000,"publicationDate":"2024-04-23","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.sciencedirect.com/science/article/pii/S016974392400073X/pdfft?md5=9ca1205b6902ee41304da3031bdead5a&pid=1-s2.0-S016974392400073X-main.pdf","citationCount":"0","resultStr":"{\"title\":\"Addressing adulteration challenges of dried oregano leaves by NIR HyperSpectral Imaging\",\"authors\":\"Veronica Ferrari ,&nbsp;Rosalba Calvini ,&nbsp;Camilla Menozzi ,&nbsp;Alessandro Ulrici ,&nbsp;Marco Bragolusi ,&nbsp;Roberto Piro ,&nbsp;Alessandra Tata ,&nbsp;Michele Suman ,&nbsp;Giorgia Foca\",\"doi\":\"10.1016/j.chemolab.2024.105133\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>Dried oregano leaves are particularly prone to adulteration because of their widespread distribution and their easy mixing with leaves of other plants of lower commercial value, such as olive, myrtle, strawberry tree, or sumac. To reveal the presence of adulteration, in this study we considered an untargeted analytical approach, which instead of involving the <em>a priori</em> selection of specific compounds of interest is focused on defining the characteristic spectral signature of authentic oregano with respect to its most frequent adulterants. NIR HyperSpectral Imaging (NIR-HSI) represents a state-of-the-art, rapid and non-destructive technique, allowing for the collection of both spectral and spatial information from the sample, making it particularly suitable for characterizing visually heterogeneous samples.</p><p>Authentication issues are typically assessed through class modelling techniques and Soft Independent Modelling of class Analogy (SIMCA) is one of the most used algorithms in this scenario. However, the high variability and heterogeneity within the authentic oregano class resulted in poor outcomes when SIMCA was applied. As an alternative, Soft Partial Least Squares Discriminant Analysis (Soft PLS-DA) algorithm was applied to differentiate authentic oregano samples from pure adulterants. Soft PLS-DA represents a hybrid approach that combines the advantages of both discriminant and class modelling techniques. The resultant classification model has indeed led to promising results, achieving a prediction efficiency of 92.9 %. Finally, based on the percentage of pixels predicted as oregano in the Soft-PLSDA prediction images, a threshold value of 10 % was established, serving as a detection limit of NIR-HSI to distinguish authentic oregano samples from adulterated ones.</p></div>\",\"PeriodicalId\":9774,\"journal\":{\"name\":\"Chemometrics and Intelligent Laboratory Systems\",\"volume\":null,\"pages\":null},\"PeriodicalIF\":3.7000,\"publicationDate\":\"2024-04-23\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"https://www.sciencedirect.com/science/article/pii/S016974392400073X/pdfft?md5=9ca1205b6902ee41304da3031bdead5a&pid=1-s2.0-S016974392400073X-main.pdf\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Chemometrics and Intelligent Laboratory Systems\",\"FirstCategoryId\":\"94\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S016974392400073X\",\"RegionNum\":2,\"RegionCategory\":\"化学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q2\",\"JCRName\":\"AUTOMATION & CONTROL SYSTEMS\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Chemometrics and Intelligent Laboratory Systems","FirstCategoryId":"94","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S016974392400073X","RegionNum":2,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"AUTOMATION & CONTROL SYSTEMS","Score":null,"Total":0}
引用次数: 0

摘要

牛至干叶特别容易掺假,因为它们分布广泛,很容易与其他商业价值较低的植物(如橄榄、桃金娘、草莓树或苏木)的叶子混在一起。为了揭示掺假现象的存在,我们在本研究中采用了一种非靶向分析方法,这种方法不涉及先验地选择特定的相关化合物,而是侧重于确定真品牛至与最常见掺假物的光谱特征。近红外超光谱成像(NIR-HSI)是一种先进、快速和非破坏性的技术,可以收集样品的光谱和空间信息,因此特别适用于描述视觉异质样品的特征。然而,在应用 SIMCA 时,真品牛至类别内的高变异性和异质性导致结果不佳。作为替代方案,我们采用了软偏最小二乘法判别分析(Soft PLS-DA)算法来区分牛至真品和纯掺假品。软偏最小二乘判别分析是一种混合方法,结合了判别技术和类别建模技术的优点。由此产生的分类模型确实取得了可喜的成果,预测效率达到 92.9%。最后,根据软 PLS-DA 预测图像中被预测为牛至的像素百分比,确定了 10% 的阈值,作为近红外-高光谱仪的检测限,以区分真假牛至样品。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
查看原文
分享 分享
微信好友 朋友圈 QQ好友 复制链接
本刊更多论文
Addressing adulteration challenges of dried oregano leaves by NIR HyperSpectral Imaging

Dried oregano leaves are particularly prone to adulteration because of their widespread distribution and their easy mixing with leaves of other plants of lower commercial value, such as olive, myrtle, strawberry tree, or sumac. To reveal the presence of adulteration, in this study we considered an untargeted analytical approach, which instead of involving the a priori selection of specific compounds of interest is focused on defining the characteristic spectral signature of authentic oregano with respect to its most frequent adulterants. NIR HyperSpectral Imaging (NIR-HSI) represents a state-of-the-art, rapid and non-destructive technique, allowing for the collection of both spectral and spatial information from the sample, making it particularly suitable for characterizing visually heterogeneous samples.

Authentication issues are typically assessed through class modelling techniques and Soft Independent Modelling of class Analogy (SIMCA) is one of the most used algorithms in this scenario. However, the high variability and heterogeneity within the authentic oregano class resulted in poor outcomes when SIMCA was applied. As an alternative, Soft Partial Least Squares Discriminant Analysis (Soft PLS-DA) algorithm was applied to differentiate authentic oregano samples from pure adulterants. Soft PLS-DA represents a hybrid approach that combines the advantages of both discriminant and class modelling techniques. The resultant classification model has indeed led to promising results, achieving a prediction efficiency of 92.9 %. Finally, based on the percentage of pixels predicted as oregano in the Soft-PLSDA prediction images, a threshold value of 10 % was established, serving as a detection limit of NIR-HSI to distinguish authentic oregano samples from adulterated ones.

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
7.50
自引率
7.70%
发文量
169
审稿时长
3.4 months
期刊介绍: Chemometrics and Intelligent Laboratory Systems publishes original research papers, short communications, reviews, tutorials and Original Software Publications reporting on development of novel statistical, mathematical, or computer techniques in Chemistry and related disciplines. Chemometrics is the chemical discipline that uses mathematical and statistical methods to design or select optimal procedures and experiments, and to provide maximum chemical information by analysing chemical data. The journal deals with the following topics: 1) Development of new statistical, mathematical and chemometrical methods for Chemistry and related fields (Environmental Chemistry, Biochemistry, Toxicology, System Biology, -Omics, etc.) 2) Novel applications of chemometrics to all branches of Chemistry and related fields (typical domains of interest are: process data analysis, experimental design, data mining, signal processing, supervised modelling, decision making, robust statistics, mixture analysis, multivariate calibration etc.) Routine applications of established chemometrical techniques will not be considered. 3) Development of new software that provides novel tools or truly advances the use of chemometrical methods. 4) Well characterized data sets to test performance for the new methods and software. The journal complies with International Committee of Medical Journal Editors'' Uniform requirements for manuscripts.
期刊最新文献
LTFM: Long-tail few-shot module with loose coupling strategy for mineral spectral identification Recent applications of analytical quality-by-design methodology for chromatographic analysis: A review Layer-wise-residual-driven approach for soft sensing in composite dynamic system based on slow and fast time-varying latent variables Applicability domain of a calibration model based on neural networks and infrared spectroscopy Machine learning based modeling for estimation of drug solubility in supercritical fluid by adjusting important parameters
×
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
现在去查看 取消
×
提示
确定
0
微信
客服QQ
Book学术公众号 扫码关注我们
反馈
×
意见反馈
请填写您的意见或建议
请填写您的手机或邮箱
已复制链接
已复制链接
快去分享给好友吧!
我知道了
×
扫码分享
扫码分享
Book学术官方微信
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术
文献互助 智能选刊 最新文献 互助须知 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 Book学术 All rights reserved.
ghs 京公网安备 11010802042870号 京ICP备2023020795号-1