4 papers
A Human-in-the-Loop Bayesian Optimization Framework for Constraint-Aware Bioprocess Development
Samuel Stricker, Claus Wirnsperger, Alessandro Butté +7
This work presents an extension to Pareto Front Guided Sampling (PFGS), a Human-in-the-Loop (HitL) Bayesian Optimization (BO) framework in which Gaussian process (GP) surrogate-der…
Holistic Bioprocess Development Across Scales Using Multi-Fidelity Batch Bayesian Optimization
Adrian Martens, Mathias Neufang, Alessandro Butté +3
Bioprocesses are central to modern biotechnology, enabling sustainable production in pharmaceuticals, specialty chemicals, cosmetics, and food. However, developing high-performing…
A Guide to Bayesian Optimization in Bioprocess Engineering
Maximilian Siska, Emma Pajak, Katrin Rosenthal +3
Bayesian optimization has become widely popular across various experimental sciences due to its favorable attributes: it can handle noisy data, perform well with relatively small d…
CarAT: Carbon Atom Tracing across Industrial Chemical Value Chains via Chemistry Language Models
Emma Pajak, David Walz, Olga Walz +3
The chemical industry is increasingly prioritising sustainability, with a focus on reducing carbon footprints to achieve net zero. By 2026, the Together for Sustainability (TfS) co…