Multivariate classification techniques and mass spectrometry as a tool in the screening of patients with fibromyalgia

被引:7
作者
Alves, Marcelo V. S. [1 ]
Maciel, Lanaia I. L. [2 ]
Ramalho, Ruver R. F. [2 ]
Lima, Leomir A. S. [3 ]
Vaz, Boniek G. [2 ]
Morais, Camilo L. M. [4 ]
Passos, Joao O. S. [5 ]
Pegado, Rodrigo [5 ]
Lima, Kassio M. G. [1 ]
机构
[1] Univ Fed Rio Grande do Norte, Inst Chem Biol Chem & Chemometr, BR-59072970 Natal, RN, Brazil
[2] Univ Fed Goias, Inst Chem, Samambaia St, BR-74690900 Goiania, Go, Brazil
[3] Estacio de Sa Goias, BR-74063010 Goiania, Go, Brazil
[4] Univ Cent Lancashire, Sch Pharm & Biomed Sci, Preston PR1 2HE, Lancs, England
[5] Univ Fed Rio Grande do Norte, Fac Hlth Sci Trairi, Postgrad Program Rehabil Sci, Trairi St, BR-59200000 Santa Cruz, RN, Brazil
关键词
PAPER SPRAY IONIZATION; ATR-FTIR SPECTROSCOPY; VARIABLE SELECTION; CANCER; METABOLOMICS; ALGORITHMS; MACHINE; BLOOD; SERUM; MS;
D O I
10.1038/s41598-021-02141-1
中图分类号
O [数理科学和化学]; P [天文学、地球科学]; Q [生物科学]; N [自然科学总论];
学科分类号
07 ; 0710 ; 09 ;
摘要
Fibromyalgia is a rheumatological disorder that causes chronic pain and other symptomatic conditions such as depression and anxiety. Despite its relevance, the disease still presents a complex diagnosis where the doctor needs to have a correct clinical interpretation of the symptoms. In this context, it is valid to study tools that assist in the screening of this disease, using chemical work techniques such as mass spectroscopy. In this study, an analytical method is proposed to detect individuals with fibromyalgia (n = 20, 10 control samples and 10 samples with fibromyalgia) from blood plasma samples analyzed by mass spectrometry with paper spray ionization and subsequent multivariate classification of the spectral data (unsupervised and supervised), in addition to the treatment of selected variables with possible associations with metabolomics. Exploratory analysis with principal component analysis (PCA) and supervised analysis with successive projections algorithm with linear discriminant analysis (SPA-LDA) showed satisfactory results with 100% accuracy for sample prediction in both groups. This demonstrates that this combination of techniques can be used as a simple, reliable and fast tool in the development of clinical diagnosis of Fibromyalgia.
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页数:8
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