Xiaojing Sun , Zhaonan You , Yu Du , Bingqian Ran , Guohua Wu , Ying Tan , Longfei Yin
{"title":"Vibrational spectroscopy of urine combined with support vector machine for lupus nephritis diagnosis research","authors":"Xiaojing Sun , Zhaonan You , Yu Du , Bingqian Ran , Guohua Wu , Ying Tan , Longfei Yin","doi":"10.1016/j.vibspec.2025.103845","DOIUrl":null,"url":null,"abstract":"<div><div>Lupus nephritis (LN) is one of the most common and serious organ manifestations of systemic lupus erythematosus (SLE), with a poor long-term prognosis and a complex diagnostic process, therefore it is important to find a simple, rapid and non-invasive method for the diagnosis of LN. This study investigated the feasibility of using surface-enhanced Raman spectroscopy (SERS) and Fourier Transform Infrared (FT-IR) spectroscopy of urine samples to classify healthy volunteers and LN patients. SERS and FT-IR data of urine samples were obtained from 100 LN patients and 100 healthy volunteers. To verify the stability of the classification algorithm, 50 independent experiments were conducted. In each experiment, the dataset was randomly divided and a classification model was established using the support vector machine (SVM) algorithm (linear kernel function). Meanwhile, it was compared with four other common classification algorithms and the results showed that SVM model had the best effect. The average classification accuracy of SERS and FT-IR spectra combined with SVM model for 50 independent experiments reached 96.97 % and 92.77 %, respectively. In addition, the features of SERS and FT-IR were spliced and then combined with SVM model for classification, corresponding to an average classification accuracy of 97.63 %. Subsequently, genetic algorithm was used to perform feature selection on the spliced features, and the 16 selected features were also input into SVM model, with an average classification accuracy of 99.47 % over 50 independent experiments. Therefore, urine vibrational spectroscopy combined with SVM model has great potential in the diagnosis of lupus nephritis.</div></div>","PeriodicalId":23656,"journal":{"name":"Vibrational Spectroscopy","volume":"140 ","pages":"Article 103845"},"PeriodicalIF":3.1000,"publicationDate":"2025-08-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Vibrational Spectroscopy","FirstCategoryId":"92","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0924203125000797","RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"CHEMISTRY, ANALYTICAL","Score":null,"Total":0}
引用次数: 0
Abstract
Lupus nephritis (LN) is one of the most common and serious organ manifestations of systemic lupus erythematosus (SLE), with a poor long-term prognosis and a complex diagnostic process, therefore it is important to find a simple, rapid and non-invasive method for the diagnosis of LN. This study investigated the feasibility of using surface-enhanced Raman spectroscopy (SERS) and Fourier Transform Infrared (FT-IR) spectroscopy of urine samples to classify healthy volunteers and LN patients. SERS and FT-IR data of urine samples were obtained from 100 LN patients and 100 healthy volunteers. To verify the stability of the classification algorithm, 50 independent experiments were conducted. In each experiment, the dataset was randomly divided and a classification model was established using the support vector machine (SVM) algorithm (linear kernel function). Meanwhile, it was compared with four other common classification algorithms and the results showed that SVM model had the best effect. The average classification accuracy of SERS and FT-IR spectra combined with SVM model for 50 independent experiments reached 96.97 % and 92.77 %, respectively. In addition, the features of SERS and FT-IR were spliced and then combined with SVM model for classification, corresponding to an average classification accuracy of 97.63 %. Subsequently, genetic algorithm was used to perform feature selection on the spliced features, and the 16 selected features were also input into SVM model, with an average classification accuracy of 99.47 % over 50 independent experiments. Therefore, urine vibrational spectroscopy combined with SVM model has great potential in the diagnosis of lupus nephritis.
期刊介绍:
Vibrational Spectroscopy provides a vehicle for the publication of original research that focuses on vibrational spectroscopy. This covers infrared, near-infrared and Raman spectroscopies and publishes papers dealing with developments in applications, theory, techniques and instrumentation.
The topics covered by the journal include:
Sampling techniques,
Vibrational spectroscopy coupled with separation techniques,
Instrumentation (Fourier transform, conventional and laser based),
Data manipulation,
Spectra-structure correlation and group frequencies.
The application areas covered include:
Analytical chemistry,
Bio-organic and bio-inorganic chemistry,
Organic chemistry,
Inorganic chemistry,
Catalysis,
Environmental science,
Industrial chemistry,
Materials science,
Physical chemistry,
Polymer science,
Process control,
Specialized problem solving.