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血浆的光谱化学分析结合后续化学计量学用于纤维肌痛检测。

Spectrochemical analysis in blood plasma combined with subsequent chemometrics for fibromyalgia detection.

机构信息

Postgraduation Program in Rehabilitation Sciences, Faculty of Health Science of Trairí, Federal University of Rio Grande do Norte, Trairí St., Santa Cruz, RN, 59200-000, Brazil.

Institute of Chemistry, Biological Chemistry and Chemometrics, Federal University of Rio Grande do Norte, Natal, 59072-970, Brazil.

出版信息

Sci Rep. 2020 Jul 16;10(1):11769. doi: 10.1038/s41598-020-68781-x.

Abstract

Fibromyalgia is a rheumatologic condition characterized by multiple and chronic body pain, and other typical symptoms such as intense fatigue, anxiety and depression. It is a very complex disease where treatment is often made by non-medicated alternatives in order to alleviate symptoms and improve the patient's quality of life. Herein, we propose a method to detect patients with fibromyalgia (n = 252, 126 controls and 126 patients with fibromyalgia) through the analysis of their blood plasma using attenuated total reflection Fourier-transform infrared (ATR-FTIR) spectroscopy in conjunction with chemometric techniques, hence, providing a low-cost, fast and accurate diagnostic approach. Different chemometric algorithms were tested to classify the spectral data; genetic algorithm with linear discriminant analysis (GA-LDA) achieved the best diagnostic results with a sensitivity of 89.5% in an external test set. The GA-LDA model identified 24 spectral wavenumbers responsible for class separation; amongst these, the Amide II (1,545 cm) and proteins (1,425 cm) were identified to be discriminant features. These results reinforce the potential of ATR-FTIR spectroscopy with multivariate analysis as a new tool to screen and detect patients with fibromyalgia in a fast, low-cost, non-destructive and minimally invasive fashion.

摘要

纤维肌痛是一种风湿性疾病,其特征是多部位慢性疼痛,以及其他典型症状,如极度疲劳、焦虑和抑郁。这是一种非常复杂的疾病,其治疗通常采用非药物替代方法,以减轻症状和提高患者的生活质量。在此,我们提出了一种通过对患者(n=252,126 名对照和 126 名纤维肌痛患者)的血浆进行衰减全反射傅里叶变换红外(ATR-FTIR)光谱分析,并结合化学计量学技术来检测纤维肌痛患者的方法,从而提供了一种低成本、快速和准确的诊断方法。测试了不同的化学计量学算法来对光谱数据进行分类;遗传算法线性判别分析(GA-LDA)在外部测试集中达到了最佳的诊断结果,灵敏度为 89.5%。GA-LDA 模型确定了 24 个对分类有贡献的光谱波数;其中,酰胺 II(1545 cm)和蛋白质(1425 cm)被鉴定为有区别的特征。这些结果证实了ATR-FTIR 光谱与多元分析相结合作为一种新的工具,以快速、低成本、非破坏性和微创的方式筛选和检测纤维肌痛患者的潜力。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8739/7366631/35a8e3638031/41598_2020_68781_Fig1_HTML.jpg

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