arXiv Machine Learning

Bayesian Optimisation under State-Preservation Constraints

The paper introduces a method for Bayesian optimisation in engineering design problems where both the objective and constraints depend on the state of a PDE solution. It proposes pre‑computing a set of controls whose linearised constraint response remains within tolerance, effectively pulling the state‑space constraint into design space and forming an ellipsoid from which well‑spread candidates can be drawn. The linear response map is refined online, and the approach is demonstrated on Tokamak divertor optimisation with plasma‑boundary preservation.

Hugging Face Trending Papers
Oct 8

Bayesian Optimisation under State-Preservation Constraints

The paper introduces a method for Bayesian optimisation in engineering design problems where both the objective and constraints depend on the state of a PDE solution. It proposes pre‑computing a set of controls whose linearised constraint response remains within tolerance, effectively pulling the state‑space constraint into design space and forming an ellipsoid from which well‑spread candidates can be drawn. The linear response map is refined online, and the approach is demonstrated on Tokamak divertor optimisation with plasma‑boundary preservation.

arXiv Machine Learning
Jul 16

Maximally Robust Satisficing Bayesian Optimization

arXiv:2607. 13652v1 Announce Type: new Abstract: Many design tasks can be cast as black-box function optimization, enabling use of Bayesian optimization to find an ideal design with minimal number of trials.

By Samuli Kinnunen, Petrus Mikkola, Antti Niskanen, Arto Klami
arXiv Machine Learning
Jul 7

Local Constrained Bayesian Optimization

arXiv:2603. 07965v2 Announce Type: replace-cross Abstract: Bayesian optimization (BO) for high-dimensional constrained problems remains a significant challenge due to the curse of dimensionality.

By Jing Jingzhe, Fan Zheyi, Szu Hui Ng, Qingpei Hu
arXiv Machine Learning
Jun 16

Towards Data-Efficient Cross-Device Generalization of Grad-Shafranov Equilibria via Transfer Learning Neural Operator

arXiv:2606. 15512v1 Announce Type: new Abstract: Real-time reconstruction of magnetohydrodynamic equilibria is essential for plasma shaping, stability assessment and feedback control in magnetic confinement fusion.

By Jay Phil Yoo, William Howes, Yashika Ghai, Kazuma Kobayashi, Souvik Chakraborty, Syed Bahauddin Alam
arXiv AI
Aug 11

Agentic Stage-One Stellarator Optimization: Autonomous Multi-Objective Search for Finite-Beta Equilibria

arXiv:2608. 01344v2 Announce Type: replace Abstract: Stage-one stellarator design searches a high-dimensional family of three-dimensional plasma boundaries and fixed-boundary MHD equilibria for configurations that jointly meet requirements on confinement, field-line topology, force balance, stability proxies, and geometry.

By Tingjia Zhang, Zhuoran Meng, Runlai Xu
arXiv Machine Learning
Jun 26

Bayesian Optimization for General Reaction Conditions

arXiv:2502. 18966v2 Announce Type: replace Abstract: General chemical reaction conditions that achieve consistently high performance across multiple substrates are important for practical applications such as library synthesis and high-throughput experimentation.

By Stefan P. Schmid, Ella Miray Rajaonson, Cher Tian Ser, Mohammad Haddadnia, Shi Xuan Leong, Al\'an Aspuru-Guzik, Agustinus Kristiadi, Kjell Jorner, Felix Strieth-Kalthoff
arXiv Machine Learning
Oct 8

ORACLE: Optimizer-Relative Alignment for Constrained LEarning

The paper introduces ORACLE, a method for constrained learning that evaluates constraint compatibility after the optimizer has taken a step, rather than before. ORACLE performs a joint endpoint linearization of diverse constraint families, constructs an alignment in the optimizer’s geometry, bounds its authority, and commits the adjustment only after validation. Experiments on eight PDE benchmarks with four different optimizers show that ORACLE matches or improves performance in 94% of configurations, outperforming other constraint-handling approaches.

By Utkarsh Grover, Wyatt Mackey, Kaixun Hua, J. Morris Chang, Xiaomin Lin