Treffer: Optimization of FTIR-PLS models for adulteration detection in sesame oil: a comparative study of genetic algorithm, particle swarm optimization, and a hybrid GA-PSO approach.

Title:
Optimization of FTIR-PLS models for adulteration detection in sesame oil: a comparative study of genetic algorithm, particle swarm optimization, and a hybrid GA-PSO approach.
Authors:
Khodabakhshian R; Department of Biosystems Engineering, Ferdowsi University of Mashhad, 9177948978 Mashhad, Iran. Electronic address: khodabakhshian@um.ac.ir., Lavasani HS; Department of Biosystems Engineering, Ferdowsi University of Mashhad, 9177948978 Mashhad, Iran., Weller P; Institute for Instrumental Analytics and Bioanalytics, Mannheim University of Applied Sciences, 68163 Mannheim, Germany.
Source:
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy [Spectrochim Acta A Mol Biomol Spectrosc] 2026 Mar 05; Vol. 348 (Pt 2), pp. 127261. Date of Electronic Publication: 2025 Nov 25.
Publication Type:
Journal Article; Comparative Study
Language:
English
Journal Info:
Publisher: Elsevier Country of Publication: England NLM ID: 9602533 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1873-3557 (Electronic) Linking ISSN: 13861425 NLM ISO Abbreviation: Spectrochim Acta A Mol Biomol Spectrosc Subsets: MEDLINE
Imprint Name(s):
Publication: : Amsterdam : Elsevier
Original Publication: [Kidlington, Oxford, U.K. ; Tarrytown, NY] : Pergamon, c1994-
Contributed Indexing:
Keywords: Chemometric modeling; FTIR spectroscopy; Genetic algorithm-PSO hybrid; Metaheuristic optimization; Oil adulteration detection
Substance Nomenclature:
8008-74-0 (Sesame Oil)
Entry Date(s):
Date Created: 20251128 Date Completed: 20251212 Latest Revision: 20251222
Update Code:
20260130
DOI:
10.1016/j.saa.2025.127261
PMID:
41313973
Database:
MEDLINE

Weitere Informationen

Fourier Transform Infrared (FTIR) spectroscopy combined with Partial Least Squares (PLS) regression has emerged as a powerful tool for detecting adulteration in edible oils. However, the high dimensionality and spectral redundancy of FTIR data often hinder model accuracy and generalizability. This study evaluates and compares the effectiveness of three metaheuristic optimization algorithms-Genetic Algorithm (GA), Particle Swarm Optimization (PSO), and a novel hybrid GA-PSO approach-for enhancing FTIR-PLS models in detecting sesame oil adulteration with canola, corn, and sunflower oils. Results demonstrated that the hybrid GA-PSO algorithm significantly outperformed standalone GA and PSO, achieving R<sup>2</sup>p = 0.985 and RMSEP = 4.92 % for canola-adulterated oil, R<sup>2</sup>p = 0.987 and RMSEP = 5.62 % for corn-adulterated oil, and R<sup>2</sup>p = 0.991 and RMSEP = 4.51 % for sunflower-adulterated oil. In contrast, baseline (non-optimized) PLSR models exhibited higher prediction errors (RMSEP >6 %). Comparative analysis confirmed that GA-PSO synergizes GA's global search capability with PSO's rapid convergence, effectively minimizing overfitting and enhancing model robustness. This study establishes hybrid metaheuristic-optimized FTIR-PLSR as a superior framework for food authentication, offering high accuracy and reliability for industrial quality control.
(Copyright © 2025 Elsevier B.V. All rights reserved.)

Declaration of competing interest The authors declare the following financial interests/personal relationships which may be considered as potential competing interests: Rasool Khodabakhshian reports financial support was provided by Parand Oil.