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傅里叶变换红外光谱和化学计量学在动物毛皮类型鉴别中的应用。

Fourier transform infrared spectroscopy and chemometrics for the discrimination of animal fur types.

机构信息

College of Science, China Agricultural University, Beijing 100193, PR China.

College of Science, China Agricultural University, Beijing 100193, PR China.

出版信息

Spectrochim Acta A Mol Biomol Spectrosc. 2022 Jun 5;274:121034. doi: 10.1016/j.saa.2022.121034. Epub 2022 Feb 26.


DOI:10.1016/j.saa.2022.121034
PMID:35248857
Abstract

Rapid and reliable animal fur identification has remained a challenge for customs inspection. The accurate distinction between fur types has a significant meaning in implementing the correct tariff policy. A variety of analytical methods have been applied to work on distinguishing animal fur types, with tools of microscopy, molecular testing, mass spectrometry, Fourier transform infrared spectroscopy (FTIR), and Raman spectroscopy. In this research, the capability of attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR) combined with pattern recognition methods was investigated for the discrimination of animal fur in six types. This work was to explore the non-destructive application of ATR-FTIR technique in discriminant analysis of animal fur. All spectra were collected by ATR-FTIR of the wavenumber ranging from 4000 to 650 cm. Data pretreatments included moving average smoothing and multiplicative scatter correction (MSC). Four supervised classification algorithms were chosen to categorize the types of fur: soft independent modeling of class analogy (SIMCA), principal component analysis linear discriminant analysis (PCA-LDA), partial least squares discriminant analysis (PLS-DA), least squares support vector machine (LS-SVM). PLS-DA and LS-SVM were both effective approaches, with a 100% classification accuracy rate. The accuracy of PCA-LDA and SIMCA was 98.33% and 99.44%, respectively. Furthermore, LS-SVM model obtained using Monte-Carlo sampling method also obtained 100% prediction accuracy, while all other methods produced misclassification. LS-SVM corrected the non-linearities for the animal fur FTIR data but also remarkably improved the prediction performance level. The results of this study revealed that the combination of ATR-FTIR and chemometrics has a huge potential for animal fur discrimination.

摘要

快速、可靠的动物皮毛鉴别一直是海关检验的难题。准确区分皮毛类型对于实施正确的关税政策具有重要意义。已经应用了各种分析方法来区分动物皮毛类型,包括显微镜、分子测试、质谱、傅里叶变换红外光谱(FTIR)和拉曼光谱。在这项研究中,研究了衰减全反射傅里叶变换红外光谱(ATR-FTIR)结合模式识别方法在六种动物皮毛鉴别中的能力。本研究旨在探索ATR-FTIR 技术在动物皮毛判别分析中的无损应用。所有光谱均通过 ATR-FTIR 在 4000 至 650 cm 的波数范围内采集。数据预处理包括移动平均平滑和乘法散射校正(MSC)。选择了四种监督分类算法对皮毛类型进行分类:软独立建模分类类比(SIMCA)、主成分分析线性判别分析(PCA-LDA)、偏最小二乘判别分析(PLS-DA)、最小二乘支持向量机(LS-SVM)。PLS-DA 和 LS-SVM 都是有效的方法,分类准确率达到 100%。PCA-LDA 和 SIMCA 的准确率分别为 98.33%和 99.44%。此外,使用蒙特卡罗抽样法建立的 LS-SVM 模型也获得了 100%的预测准确率,而其他方法均产生了误分类。LS-SVM 不仅纠正了动物皮毛 FTIR 数据的非线性,而且显著提高了预测性能水平。本研究结果表明,ATR-FTIR 与化学计量学相结合在动物皮毛鉴别方面具有巨大的潜力。

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引用本文的文献

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Discrimination of mongoose hair from domestic cattle hair, human hair, and synthetic fiber using FTIR spectroscopy and chemometric analysis: a rapid, cost-effective, and field-deployable tool for wildlife forensics.

RSC Adv. 2024-11-19

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