A survey on high-dimensional Gaussian process modeling with application to Bayesian optimization
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Abstract (arXiv)
Bayesian Optimization, the application of Bayesian function approximation to finding optima of expensive functions, has exploded in popularity in recent years. In particular, much attention has been paid to improving its efficiency on problems with many parameters to optimize. This attention has trickled down to the workhorse of high dimensional BO, high dimensional Gaussian process regression, which is also of independent interest. The great flexibility that the Gaussian process prior implies is a boon when modeling complicated, low dimensional surfaces but simply says too little when dimension grows too large. A variety of structural model assumptions have been tested to tame high dimensions, from variable selection and additive decomposition to low dimensional embeddings and beyond. Most of these approaches in turn require modifications of the acquisition function optimization strategy as well. Here we review the defining structural model assumptions and discuss the benefits and drawbacks of these approaches in practice.
Key facts. Cited by 77 papers in the map (data through 14 Oct 2026). First posted on arXiv 9 Nov 2021.
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Citing papers per year: 2021: 1; 2022: 8; 2023: 16; 2024: 19; 2025: 19; 2026: 14.
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- 2024Vanilla Bayesian Optimization Performs Great in High Dimensionscited by 92
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- 2023Increasing the Scope as You Learn: Adaptive Bayesian Optimization in Nested Subspacescited by 52
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- 2024A survey and benchmark of high-dimensional Bayesian optimization of discrete sequencescited by 23
- 2025Understanding High-Dimensional Bayesian Optimizationcited by 20
- 2023Comparison of High-Dimensional Bayesian Optimization Algorithms on BBOBcited by 19
- 2024MetaMetrics: Calibrating Metrics For Generation Tasks Using Human Preferencescited by 15
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50 most cited of 77 All 77 (JSON)
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- 2026BOAT: Navigating the Sea of In Silico Predictors for Antibody Design via Multi-Objective Bayesian Optimization15 Apr 2026
- 2026Do We Really Need to Approach the Entire Pareto Front in Many-Objective Bayesian Optimisation?10 Apr 2026
- 2026Quality-Controlled Active Learning via Gaussian Processes for Robust Structure-Property Learning in Autonomous Microscopy31 Mar 2026
- 2026LAGO: A Local-Global Optimization Framework Combining Trust Region Methods and Bayesian Optimization3 Mar 2026
- 2026Goal-Oriented Influence-Maximizing Data Acquisition for Learning and Optimization23 Feb 2026
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- 2025BBOPlace-Bench: Benchmarking Black-Box Optimization for Chip Placement27 Oct 2025
- 2025BO4Mob: Bayesian Optimization Benchmarks for High-Dimensional Urban Mobility Problem21 Oct 2025
- 2025Adaptive Individual Uncertainty under Out-Of-Distribution Shift with Expert-Routed Conformal Prediction17 Oct 2025
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- 2025Model-free Reinforcement Learning for Model-based Control: Towards Safe, Interpretable and Sample-efficient Agents17 Jul 2025
- 2025Preference Learning with Response Time: Robust Losses and Guarantees28 May 2025
- 2025Adaptive Replication Strategies in Trust-Region-Based Bayesian Optimization of Stochastic Functions29 Apr 2025
- 2025An Adaptive Dropout Approach for High-Dimensional Bayesian Optimization15 Apr 2025
- 2025Gradient-based Sample Selection for Faster Bayesian Optimization10 Apr 2025
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- 2025High Dimensional Bayesian Optimization using Lasso Variable Selection2 Apr 2025
- 2025PSO-UNet: Particle Swarm-Optimized U-Net Framework for Precise Multimodal Brain Tumor Segmentation24 Mar 2025
- 2025Understanding High-Dimensional Bayesian Optimization13 Feb 2025
- 2025Distribution Transformers: Fast Approximate Bayesian Inference With On-The-Fly Prior Adaptation4 Feb 2025
- 2024Safe Bayesian Optimization for the Control of High-Dimensional Embodied Systems29 Dec 2024
- 2024Regional Expected Improvement for Efficient Trust Region Selection in High-Dimensional Bayesian Optimization16 Dec 2024
- 2024Navigating in High-Dimensional Search Space: A Hierarchical Bayesian Optimization Approach30 Oct 2024
- 2024MetaMetrics: Calibrating Metrics For Generation Tasks Using Human Preferences3 Oct 2024
- 2024Bayesian Optimization for Non-Convex Two-Stage Stochastic Optimization Problems30 Aug 2024
- 2024A survey and benchmark of high-dimensional Bayesian optimization of discrete sequences7 Jun 2024
- 2024Offline Multi-Objective Optimization6 Jun 2024
- 2024Minimizing UCB: a Better Local Search Strategy in Local Bayesian Optimization24 May 2024
- 2024Dynamic Online Ensembles of Basis Expansions2 May 2024
- 2024Machine Learning-Guided Design of Non-Reciprocal and Asymmetric Elastic Chiral Metamaterials19 Apr 2024
- 2024Expected Coordinate Improvement for High-Dimensional Bayesian Optimization18 Apr 2024
- 2024An Adaptive Dimension Reduction Estimation Method for High-dimensional Bayesian Optimization8 Mar 2024
- 2024Weighted-Sum of Gaussian Process Latent Variable Models14 Feb 2024
- 2024Combining additivity and active subspaces for high-dimensional Gaussian process modeling6 Feb 2024
- 2024High-dimensional Bayesian Optimization via Covariance Matrix Adaptation Strategy5 Feb 2024
- 2024Vanilla Bayesian Optimization Performs Great in High Dimensions3 Feb 2024
- 2024Co-orchestration of Multiple Instruments to Uncover Structure-Property Relationships in Combinatorial Libraries3 Feb 2024
50 newest of 77 All 77 (JSON)
- 2024Vanilla Bayesian Optimization Performs Great in High Dimensionscited by 92
- 2022Recent Advances in Bayesian Optimizationcited by 76
- 2023Increasing the Scope as You Learn: Adaptive Bayesian Optimization in Nested Subspacescited by 52
- 2022Monte Carlo Tree Search based Variable Selection for High Dimensional Bayesian Optimizationcited by 37
- 2023Bounce: Reliable High-Dimensional Bayesian Optimization for Combinatorial and Mixed Spacescited by 28
- 2023Uncertainty Quantification in Machine Learning for Engineering Design and Health Prognostics: A Tutorialcited by 27
- 2022The Neural Process Family: Survey, Applications and Perspectivescited by 23
- 2023Macro Placement by Wire-Mask-Guided Black-Box Optimizationcited by 23
- 2024A survey and benchmark of high-dimensional Bayesian optimization of discrete sequencescited by 23
- 2025Understanding High-Dimensional Bayesian Optimizationcited by 20
- 2023Comparison of High-Dimensional Bayesian Optimization Algorithms on BBOBcited by 19
- 2024MetaMetrics: Calibrating Metrics For Generation Tasks Using Human Preferencescited by 15
12 most cited of 75 All 75 (JSON)
- 2026Isotropic Gaussian Processes Improve Vanilla Bayesian Optimization in High Dimensions5 Oct 2026
- 2026MF-SCBO : Multi-fidelity Scalable Constrained Bayesian Optimization24 Sep 2026
- 2026Converge Then Diversify: Decoupling Convergence and Diversity in Multi-Objective Bayesian Optimisation11 Sep 2026
- 2026Closed-Loop Molecular Inverse Design with Semantic LLM Surrogates24 Aug 2026
- 2026On the Uncertainty Quantification Ability of Tabular Foundation Models31 May 2026
- 2026Automated Random Embedding for Practical Bayesian Optimization with Unknown Effective Dimension22 May 2026
- 2026Rethinking Trust Region Bayesian Optimization in High Dimensions24 Apr 2026
- 2026BOAT: Navigating the Sea of In Silico Predictors for Antibody Design via Multi-Objective Bayesian Optimization15 Apr 2026
- 2026Do We Really Need to Approach the Entire Pareto Front in Many-Objective Bayesian Optimisation?10 Apr 2026
- 2026Quality-Controlled Active Learning via Gaussian Processes for Robust Structure-Property Learning in Autonomous Microscopy31 Mar 2026
- 2026LAGO: A Local-Global Optimization Framework Combining Trust Region Methods and Bayesian Optimization3 Mar 2026
- 2026Goal-Oriented Influence-Maximizing Data Acquisition for Learning and Optimization23 Feb 2026
12 newest of 75 All 75 (JSON)