Barlow Twins for semi-supervised learning in NIR spectroscopy

Near-infrared (NIR) spectroscopy is a widely used technology in the horticulture industry for non-destructive fruit grading. Partial Least Squares (PLS) regression is the dominant method for producing fruit quality predictions from measured spectra. Alternative deep learning methods have shown promise, but often require large amounts of labelled data to train. This study proposes a semi-supervised method based on Barlow Twins to include unlabelled data in the training process. We adopt the Barlow Twins method by using repeated measurements on the same fruit from different devices as different “views” to encode into the same latent space and combine the encoder network with a regression head for prediction. Our approach demonstrates improved performance over PLS with up to 17% lower RMSE, especially when the labelled data is limited. The Barlow loss function also improves calibration transfer results. • Novel application of Barlow Twins contrastive learning to NIR spectroscopy using repeated measurements from different devices. • Semi-supervised learning allows for unlabelled spectra to assist in training. • Up to 50% reduction in RMSE in calibration transfer tasks compared to training on the MSE loss only. • The best performance gains were observed at small labelled training sizes. • The Barlow Twins loss was not detrimental at large training set sizes.

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Publication Details

Journal
Chemometrics and Intelligent Laboratory Systems
Published
2026-02-14
DOI
https://doi.org/10.1016/j.chemolab.2026.105664
Primary Topic
Spectroscopy and Chemometric Analyses
Type
article
Field-Weighted Citation Impact
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article

Barlow Twins for semi-supervised learning in NIR spectroscopy

Eibe Frank, Mark Wohlers, Geoffrey Holmes, Andrew McGlone
Chemometrics and Intelligent Laboratory Systems
Spectroscopy and Chemometric Analyses
article

Barlow Twins for semi-supervised learning in NIR spectroscopy

Eibe Frank, Mark Wohlers, Geoffrey Holmes, Andrew McGlone
article en

Abstract

Near-infrared (NIR) spectroscopy is a widely used technology in the horticulture industry for non-destructive fruit grading. Partial Least Squares (PLS) regression is the dominant method for producing fruit quality predictions from measured spectra. Alternative deep learning methods have shown promise, but often require large amounts of labelled data to train. This study proposes a semi-supervised method based on Barlow Twins to include unlabelled data in the training process. We adopt the Barlow Twins method by using repeated measurements on the same fruit from different devices as different “views” to encode into the same latent space and combine the encoder network with a regression head for prediction. Our approach demonstrates improved performance over PLS with up to 17% lower RMSE, especially when the labelled data is limited. The Barlow loss function also improves calibration transfer results. • Novel application of Barlow Twins contrastive learning to NIR spectroscopy using repeated measurements from different devices. • Semi-supervised learning allows for unlabelled spectra to assist in training. • Up to 50% reduction in RMSE in calibration transfer tasks compared to training on the MSE loss only. • The best performance gains were observed at small labelled training sizes. • The Barlow Twins loss was not detrimental at large training set sizes.

Chemometrics and Intelligent Laboratory SystemsVol. 272
University of Waikato (NZ), Unitec Institute of Technology (NZ)
Industry, innovation and infrastructure
Openalex Percentile: Top 54%
Spectroscopy and Chemometric Analyses
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Barlow Twins for semi-supervised learning in NIR spectroscopy — Eibe Frank, Mark Wohlers, et al. · Chemometrics and Intelligent Laboratory Systems (2026) | TGRS Research Map | TGRS