arXiv Machine Learning

mlr3mbo: Bayesian Optimization in R

arXiv:2603. 29730v2 Announce Type: replace-cross Abstract: We present mlr3mbo, a modular toolbox for Bayesian optimization in R.

arXiv Machine Learning
Jul 14

Modernizing HEBO: a robust Bayesian optimization baseline for practical heteroskedastic and non-stationary problems

arXiv:2607. 10669v1 Announce Type: new Abstract: Bayesian optimization is increasingly used to guide data-efficient experimentation in chemistry, materials science, and related laboratory settings, but its practical performance depends strongly on how well surrogate-model assumptions match the geometry and noise structure of the underlying objective.

By L. A. Zhukov, E. V. Shaburova, D. V. Antonets
arXiv Machine Learning
Aug 3

Frugal Bayesian Optimization: Scalable Surrogates for Data- and Resource-Limited Discovery

arXiv:2607. 29225v1 Announce Type: new Abstract: Bayesian Optimization (BO) is widely adopted for data-efficient optimization in scientific and engineering applications, yet its computational cost is rarely evaluated alongside optimization performance.

By Panagiotis Krokidas, Christoforos Rekatsinas, Vassilis Sioros, Grigorios M. Chatziathanasiou, Efi-Maria Papia, George Giannakopoulos
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 AI
Aug 6

Out-Of-The-Loop Multi-Fidelity Bayesian Optimization

arXiv:2608. 04113v1 Announce Type: cross Abstract: Black-box optimization is a ubiquitous problem in science and engineering, often dealing with expensive objective functions with cheaper lower-fidelity proxies available.

By Gustavo Sutter, Hao Wang, Luis Ricardez-Sandoval, Pascal Poupart, Agustinus Kristiadi
arXiv Machine Learning
Jun 2

Local Preferential Bayesian Optimization

arXiv:2606. 02351v1 Announce Type: new Abstract: Bayesian optimization (BO) is a popular and effective approach for tuning expensive, noisy experiments, but requires the formulation of an explicit objective function.

By Johanna Menn, Miriam Kober, Paul Brunzema, David Stenger, Sebastian Trimpe
arXiv AI
Jul 13

LLM-Driven Evolutionary Generation of Multi-Objective Bayesian Optimization Algorithms

arXiv:2607. 08791v1 Announce Type: cross Abstract: Designing effective multi-objective Bayesian optimization (MOBO) algorithms requires balancing many interdependent design choices whose optimal configuration is problem-dependent and typically demands deep expertise.

By Georgios Laskaris, Reuben Brasher, Niki van Stein, Elena Raponi, Thomas B\"ack, Florian Neukart
arXiv AI
Jul 24

JAXBench: Benchmarking Autonomous TPU Kernel Optimization

arXiv:2607. 20466v1 Announce Type: new Abstract: Rigorous benchmarks have driven progress in autonomous GPU kernel performance optimization by establishing a shared target to hillclimb on, but no equivalent exists for TPUs.

By Arya Tschand, Charles Hong, Julian Walker, Nina Cai, Shangkun Wang, Suvinay Subramanian, Sundar Dev, Vijay Janapa Reddi, Amir Yazdanbakhsh, Sethu Sankaran