Recent advances in Bayesian optimization

X Wang, Y Jin, S Schmitt, M Olhofer - ACM Computing Surveys, 2023 - dl.acm.org
Bayesian optimization has emerged at the forefront of expensive black-box optimization due
to its data efficiency. Recent years have witnessed a proliferation of studies on the …

A tutorial on Bayesian optimization

PI Frazier - arXiv preprint arXiv:1807.02811, 2018 - arxiv.org
Bayesian optimization is an approach to optimizing objective functions that take a long time
(minutes or hours) to evaluate. It is best-suited for optimization over continuous domains of …

BoTorch: A framework for efficient Monte-Carlo Bayesian optimization

M Balandat, B Karrer, D Jiang… - Advances in neural …, 2020 - proceedings.neurips.cc
Bayesian optimization provides sample-efficient global optimization for a broad range of
applications, including automatic machine learning, engineering, physics, and experimental …

[图书][B] Surrogates: Gaussian process modeling, design, and optimization for the applied sciences

RB Gramacy - 2020 - taylorfrancis.com
Computer simulation experiments are essential to modern scientific discovery, whether that
be in physics, chemistry, biology, epidemiology, ecology, engineering, etc. Surrogates are …

Transformer neural processes: Uncertainty-aware meta learning via sequence modeling

T Nguyen, A Grover - arXiv preprint arXiv:2207.04179, 2022 - arxiv.org
Neural Processes (NPs) are a popular class of approaches for meta-learning. Similar to
Gaussian Processes (GPs), NPs define distributions over functions and can estimate …

Bayesian optimization

PI Frazier - Recent advances in optimization and modeling …, 2018 - pubsonline.informs.org
Bayesian optimization is an approach to optimizing objective functions that take a long time
(minutes or hours) to evaluate. It is best suited for optimization over continuous domains of …

Auto-WEKA 2.0: Automatic model selection and hyperparameter optimization in WEKA

L Kotthoff, C Thornton, HH Hoos, F Hutter… - Journal of Machine …, 2017 - jmlr.org
WEKA is a widely used, open-source machine learning platform. Due to its intuitive interface,
it is particularly popular with novice users. However, such users often find it hard to identify …

Taking the human out of the loop: A review of Bayesian optimization

B Shahriari, K Swersky, Z Wang… - Proceedings of the …, 2015 - ieeexplore.ieee.org
Big Data applications are typically associated with systems involving large numbers of
users, massive complex software systems, and large-scale heterogeneous computing and …

[HTML][HTML] Constrained Bayesian optimization for automatic chemical design using variational autoencoders

RR Griffiths, JM Hernández-Lobato - Chemical science, 2020 - pubs.rsc.org
Automatic Chemical Design is a framework for generating novel molecules with optimized
properties. The original scheme, featuring Bayesian optimization over the latent space of a …

Multi-fidelity cost-aware Bayesian optimization

ZZ Foumani, M Shishehbor, A Yousefpour… - Computer Methods in …, 2023 - Elsevier
Bayesian optimization (BO) is increasingly employed in critical applications such as
materials design and drug discovery. An increasingly popular strategy in BO is to forgo the …