Bridging Spectral Gaps: Cross-Device Model Generalization in Blood-Based Infrared Spectroscopy

This paper presents a solution to the challenge of cross-device model generalization in blood-based infrared spectroscopy. As infrared spectroscopy becomes increasingly popular for analyzing human blood, ensuring that machine learning models trained on one device can be effectively transferred to others is essential. However, variations in device characteristics often reduce model performance when applied across different devices. To address this issue, we propose a straightforward domain adaptation method based on data augmentation incorporating device-specific differences. By expanding the training data to include a broader range of nuances, our approach enhances the model's ability to adapt to the unique characteristics of various devices. We validate the effectiveness of our method through experimental testing on two Fourier-Transform Infrared (FTIR) spectroscopy devices from different research laboratories, demonstrating improved prediction accuracy and reliability.

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Publication Details

Journal
Analytical Chemistry
Published
2025-05-07
DOI
https://doi.org/10.1021/acs.analchem.5c00185
Citations
1
Primary Topic
Spectroscopy Techniques in Biomedical and Chemical Research
Type
article
Field-Weighted Citation Impact
1.63
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article

Bridging Spectral Gaps: Cross-Device Model Generalization in Blood-Based Infrared Spectroscopy

Kosmas V. Kepesidis, Mihaela Žigman, Thomas Wilhelm Bocklitz, Frank Fleischmann et al.
1 citations
Analytical Chemistry
Spectroscopy Techniques in Biomedical and Chemical Research
1.63
article

Bridging Spectral Gaps: Cross-Device Model Generalization in Blood-Based Infrared Spectroscopy

Kosmas V. Kepesidis, Mihaela Žigman, Thomas Wilhelm Bocklitz, Frank Fleischmann, Niklas Leopold‐Kerschbaumer, Flora B. Nemeth, Diana Debreceni, Krisztian Borbely, David Mazurencu-Marinescu-Pele
article en
1 citations

Abstract

This paper presents a solution to the challenge of cross-device model generalization in blood-based infrared spectroscopy. As infrared spectroscopy becomes increasingly popular for analyzing human blood, ensuring that machine learning models trained on one device can be effectively transferred to others is essential. However, variations in device characteristics often reduce model performance when applied across different devices. To address this issue, we propose a straightforward domain adaptation method based on data augmentation incorporating device-specific differences. By expanding the training data to include a broader range of nuances, our approach enhances the model's ability to adapt to the unique characteristics of various devices. We validate the effectiveness of our method through experimental testing on two Fourier-Transform Infrared (FTIR) spectroscopy devices from different research laboratories, demonstrating improved prediction accuracy and reliability.

Analytical ChemistryVol. 97(19)
Schiller International University (FR), Leibniz Institute of Photonic Technology (DE), Max Planck Institute of Quantum Optics (DE), Molecular Fingerprint (Sweden) (SE), Joint Attosecond Science Laboratory (CA), Centre for DNA Fingerprinting and Diagnostics (IN), Ludwig-Maximilians-Universität München (DE)
Openalex Percentile: Top 15%
Spectroscopy Techniques in Biomedical and Chemical Research
1.63
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Bridging Spectral Gaps: Cross-Device Model Generalization in Blood-Based Infrared Spectroscopy — Kosmas V. Kepesidis, Mihaela Žigman, et al. · Analytical Chemistry (2025) | TGRS Research Map | TGRS