Lyophilized nasal swabs for COVID-19 detection by ATR-FTIR spectroscopy: Machine learning-based approach

IF 3.3 3区 生物学 Q2 BIOCHEMISTRY & MOLECULAR BIOLOGY
Zubia Shahid , Khulla Naseer , Irshad Hussain , Javaria Qazi
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引用次数: 0

Abstract

The COVID-19 pandemic continues to pose challenges for global health. The disease burden and diagnostic pressure has forced scientists to explore alternate diagnostic tools beyond the standard PCR testing. One such promising tool is the use of spectroscopy-based diagnostics. The objective of this study is to assess the potential of ATR-FTIR spectroscopy, applied to lyophilized nasal swab samples to discriminate between healthy and infected COVID-19 patients. Equal number (55 each) of positive and negative freeze-dried nasal swab samples were analyzed. After pre-processing, average mean spectra (600–4000 cm−1) showed significant variations between healthy and infected sample types. Clear spectral variations were recorded at 17 locations, of which, 13 peaks were observed in COVID-19 spectra while 4 peaks were observed in negative sample spectra. Statistical discrimination was done using principal component analysis (PCA), linear discriminant analysis (LDA) and support vector machine (SVM). The first two principal components (PCs) showed a combined variance of 76 %. Classification accuracy of 100 % were observed in the LDA graph using Quadratic kernel. Similarly, SVM model with both internal validation and external validation confirmed the robustness with a 100 % classification accuracy. These results show that lyophilized nasal swab samples are the ideal sample choice for FTIR-based analysis of COVID-19. This sample preparation method coupled with spectroscopy can serve as a robust and accessible diagnostic tool for post-covid testing.
冻干鼻拭子用于ATR-FTIR光谱检测COVID-19:基于机器学习的方法
2019冠状病毒病大流行继续对全球卫生构成挑战。疾病负担和诊断压力迫使科学家探索标准PCR检测之外的替代诊断工具。其中一个很有前途的工具是基于光谱的诊断。本研究的目的是评估应用于冻干鼻拭子样本的ATR-FTIR光谱技术区分健康和感染COVID-19患者的潜力。分析等量(各55份)阳性和阴性冻干鼻拭子样本。预处理后,平均光谱(600-4000 cm−1)显示健康和感染样品类型之间存在显著差异。在17个位置记录到明显的光谱变化,其中在COVID-19光谱中观察到13个峰,在阴性样品光谱中观察到4个峰。采用主成分分析(PCA)、线性判别分析(LDA)和支持向量机(SVM)进行统计判别。前两个主成分(PCs)的总方差为76%。使用二次核对LDA图进行分类,准确率达到100%。同样,同时具有内部验证和外部验证的SVM模型也以100%的分类准确率证实了其鲁棒性。这些结果表明,冻干鼻拭子样本是基于fir分析COVID-19的理想样本选择。这种样品制备方法与光谱学相结合,可以作为一种强大且易于获取的诊断工具,用于covid - 19后检测。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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来源期刊
Biophysical chemistry
Biophysical chemistry 生物-生化与分子生物学
CiteScore
6.10
自引率
10.50%
发文量
121
审稿时长
20 days
期刊介绍: Biophysical Chemistry publishes original work and reviews in the areas of chemistry and physics directly impacting biological phenomena. Quantitative analysis of the properties of biological macromolecules, biologically active molecules, macromolecular assemblies and cell components in terms of kinetics, thermodynamics, spatio-temporal organization, NMR and X-ray structural biology, as well as single-molecule detection represent a major focus of the journal. Theoretical and computational treatments of biomacromolecular systems, macromolecular interactions, regulatory control and systems biology are also of interest to the journal.
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