Deep Learning for Model Calibration in Simulation of Itaconic Acid Production

Fuente: arXiv
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Autori principali: Fokina, Daria, Baldan, Marco, Romankiewicz, Constantin, Laudensack, Wolfgang, Ulber, Roland, Bortz, Michael
Natura: Preprint
Pubblicazione: 2026
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author Fokina, Daria
Baldan, Marco
Romankiewicz, Constantin
Laudensack, Wolfgang
Ulber, Roland
Bortz, Michael
author_facet Fokina, Daria
Baldan, Marco
Romankiewicz, Constantin
Laudensack, Wolfgang
Ulber, Roland
Bortz, Michael
contents In this study, deep learning is used to estimate kinetic parameters for modeling itaconic acid production based on real batch experiments conducted at different agitation speeds and reactor scales. Two deep learning strategies, namely direct deep learning (DDL) and generative conditional flow matching (CFM) are compared and benchmarked against nonlinear regression as a reference method. Compared with DDL, CFM consistently yields more accurate results. The concentration profiles predicted by CFM closely match those obtained from nonlinear regression, whereas DDL results in larger deviations. Similar behavior is observed in the scale-up experiments, where the CFM model again generalizes better and is more robust than the direct approach. These findings demonstrate that CFM can reliably predict system behavior across different operating conditions and scales, offering a flexible and data-efficient framework for parameter estimation in dynamic bioprocess models.
format Preprint
id arxiv_https___arxiv_org_abs_2604_22496
institution arXiv
publishDate 2026
record_format arxiv
spellingShingle Deep Learning for Model Calibration in Simulation of Itaconic Acid Production
Fokina, Daria
Baldan, Marco
Romankiewicz, Constantin
Laudensack, Wolfgang
Ulber, Roland
Bortz, Michael
Machine Learning
In this study, deep learning is used to estimate kinetic parameters for modeling itaconic acid production based on real batch experiments conducted at different agitation speeds and reactor scales. Two deep learning strategies, namely direct deep learning (DDL) and generative conditional flow matching (CFM) are compared and benchmarked against nonlinear regression as a reference method. Compared with DDL, CFM consistently yields more accurate results. The concentration profiles predicted by CFM closely match those obtained from nonlinear regression, whereas DDL results in larger deviations. Similar behavior is observed in the scale-up experiments, where the CFM model again generalizes better and is more robust than the direct approach. These findings demonstrate that CFM can reliably predict system behavior across different operating conditions and scales, offering a flexible and data-efficient framework for parameter estimation in dynamic bioprocess models.
title Deep Learning for Model Calibration in Simulation of Itaconic Acid Production
topic Machine Learning
url https://arxiv.org/abs/2604.22496