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Adaptive multi-fidelity optimization with fast learning rates Enhancing AI and Dynamical Subseasonal Forecasts with Probabilistic Bias Correction Sample Complexity Bounds for Stochastic Shortest Path with a Generative Model The Harder Path: Last Iterate Convergence for Uncoupled Learning in Zero-Sum Games with Bandit Feedback Stylistic-STORM (ST-STORM) : Perceiving the Semantic Nature of Appearance Collective Kernel EFT for Pre-activation ResNets PRIM-cipal components analysis One-Shot Generative Flows: Existence and Obstructions Structural interpretability in SVMs with truncated orthogonal polynomial kernels Amortized Optimal Transport from Sliced Potentials MinShap: A Modified Shapley Value Approach for Feature Selection Unsupervised feature selection using Bayesian Tucker decomposition Multi-User mmWave Beam and Rate Adaptation via Combinatorial Satisficing Bandits Best of both worlds: Stochastic & adversarial best-arm identification Scalable Model-Based Clustering with Sequential Monte Carlo Expert-Guided Class-Conditional Goodness-of-Fit Scores for Interpretable Classification with Informative Missingness: An Application to Seismic Monitoring Lightweight Geometric Adaptation for Training Physics-Informed Neural Networks Gating Enables Curvature: A Geometric Expressivity Gap in Attention Zeroth-Order Optimization at the Edge of Stability Differentially Private Conformal Prediction CLion: Efficient Cautious Lion Optimizer with Enhanced Generalization Generative Augmented Inference Improving Machine Learning Performance with Synthetic Augmentation PAC-MCTS: Bias-Aware Pruning for Robust LLM-Guided Search and Planning Path-Sampled Integrated Gradients Heat and Matérn Kernels on Matchings Doubly Outlier-Robust Online Infinite Hidden Markov Model Momentum Further Constrains Sharpness at the Edge of Stochastic Stability Multistage Conditional Compositional Optimization BOAT: Navigating the Sea of In Silico Predictors for Antibody Design via Multi-Objective Bayesian Optimization
Revisiting Bayesian Optimization in the light of the COCO...
Rodolphe Le Riche, Victor Picheny · 2021-03-31 · via stat.ML updates on arXiv.org

It is commonly believed that Bayesian optimization (BO) algorithms are highly efficient for optimizing numerically costly functions. However, BO is not often compared to widely different alternatives, and is mostly tested on narrow sets of problems (multimodal, low-dimensional functions), which makes it difficult to assess where (or if) they actually achieve state-of-the-art performance. Moreover, several aspects in the design of these algorithms vary across implementations without a clear recommendation emerging from current practices, and many of these design choices are not substantiated by authoritative test campaigns. This article reports a large investigation about the effects on the performance of (Gaussian process based) BO of common and less common design choices. The experiments are carried out with the established COCO (COmparing Continuous Optimizers) software. It is found that a small initial budget, a quadratic trend, high-quality optimization of the acquisition criterion bring consistent progress. Using the GP mean as an occasional acquisition contributes to a negligible additional improvement. Warping degrades performance. The Matérn 5/2 kernel is a good default but it may be surpassed by the exponential kernel on irregular functions. Overall, the best EGO variants are competitive or improve over state-of-the-art algorithms in dimensions less or equal to 5 for multimodal functions. The code developed for this study makes the new version (v2.1.1) of the R package DiceOptim available on CRAN. The structure of the experiments by function groups allows to define priorities for future research on Bayesian optimization.