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Bayesian uncertainty quantification for anaerobic digestion models

Picard-Weibel, Antoine; Capson-Tojo, Gabriel; Guedj, Benjamin; Moscoviz, Roman; (2024) Bayesian uncertainty quantification for anaerobic digestion models. Bioresource Technology , 394 , Article 130147. 10.1016/j.biortech.2023.130147.

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Abstract

Uncertainty quantification is critical for ensuring adequate predictive power of computational models used in biology. Focusing on two anaerobic digestion models, this article introduces a novel generalized Bayesian procedure, called VarBUQ, ensuring a correct tradeoff between flexibility and computational cost. A benchmark against three existing methods (Fisher's information, bootstrapping and Beale's criteria) was conducted using synthetic data. This Bayesian procedure offered a good compromise between fitting ability and confidence estimation, while the other methods proved to be repeatedly overconfident. The method's performances notably benefitted from inductive bias brought by the prior distribution, although it requires careful construction. This article advocates for more systematic consideration of uncertainty for anaerobic digestion models and showcases a new, computationally efficient Bayesian method. To facilitate future implementations, a Python package called 'aduq' is made available.

Type: Article
Title: Bayesian uncertainty quantification for anaerobic digestion models
Location: England
DOI: 10.1016/j.biortech.2023.130147
Publisher version: http://dx.doi.org/10.1016/j.biortech.2023.130147
Language: English
Additional information: This version is the author accepted manuscript. For information on re-use, please refer to the publisher’s terms and conditions.
Keywords: Biochemical reaction networks, Computational model, Confidence regions, Predictive power
UCL classification: UCL
UCL > Provost and Vice Provost Offices > UCL BEAMS
UCL > Provost and Vice Provost Offices > UCL BEAMS > Faculty of Engineering Science
UCL > Provost and Vice Provost Offices > UCL BEAMS > Faculty of Engineering Science > Dept of Computer Science
URI: https://discovery.ucl.ac.uk/id/eprint/10183793
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