Development of a chemometric-assisted SERS method for simultaneous analysis of HDL and LDL cholesterol in blood serum

Rimsha Khan1, Kinza Khan1, Haq Nawaz1

  • 1Department of Chemistry, University of Agriculture Faisalabad, Faisalabad 38000, Pakistan.

Insights

Surface-enhanced Raman spectroscopy (SERS) effectively profiles High-density lipoproteins (HDL) and Low-density lipoproteins (LDL) cholesterol in blood serum. Advanced machine learning, specifically SVM-SMOTE, enhances accuracy in differentiating these critical lipid markers for cardiovascular disease risk assessment.

Area of Science:

  • Biomedical Engineering
  • Analytical Chemistry
  • Clinical Diagnostics

Background:

  • Cardiovascular diseases (CVD) are a leading cause of mortality globally.
  • Abnormal concentrations of High-density lipoproteins (HDL) and Low-density lipoproteins (LDL) are key contributors to CVD.
  • Accurate differentiation of HDL and LDL cholesterol is crucial for CVD risk assessment.

Purpose of the Study:

  • To compare High-density lipoproteins (HDL) and Low-density lipoproteins (LDL) cholesterol using Surface-enhanced Raman spectroscopy (SERS).
  • To apply chemometric and machine learning techniques for accurate lipid profiling and differentiation.
  • To validate the efficacy of SVM-SMOTE in handling imbalanced lipid concentration data.

Main Methods:

  • Utilized Surface-enhanced Raman spectroscopy (SERS) with silver nanoparticles (Ag-NPs) for spectral analysis of clinical blood serum samples.
  • Employed Principal Component Analysis (PCA) for differentiating HDL and LDL cholesterol spectral features.
  • Applied Support Vector Machine-Synthetic minority over-sampling technique (SVM-SMOTE) to address data imbalance and improve classification accuracy.

Main Results:

  • SERS successfully identified distinct spectral features for HDL and LDL cholesterol.
  • PCA effectively differentiated between HDL and LDL cholesterol in blood serum samples.
  • SVM-SMOTE demonstrated improved performance, slightly increasing the macro-average Area Under the Curve (AUC) from 0.97 to 0.98, while maintaining a test AUC of 0.95.

Conclusions:

  • SERS, combined with chemometric and advanced machine learning, provides an accurate method for comparative profiling of HDL and LDL cholesterol.
  • The SVM-SMOTE model shows high accuracy and validation for differentiating lipid concentrations, reducing overfitting risks.
  • This approach holds significant potential for improved CVD risk assessment through precise lipid analysis.

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