HyperMC is a multi‑fidelity hyperparameter tuning framework for stochastic gradient Markov chain Monte Carlo (SGMCMC) that combines Hyperband-style resource allocation with kernel Stein discrepancy (KSD) evaluation. It uses successive‑halving brackets to explore a continuous hyperparameter space while progressively refining promising configurations within a fixed computational budget. Robust HyperMC further introduces global grid initialization and elite‑guided local refinement to reduce sensitivity to random candidate generation and noisy evaluations, and theoretical analysis shows that the successive‑halving component selects a near‑optimal configuration with high probability under suitable conditions.
arXiv:2502. 04646v2 Announce Type: replace-cross Abstract: Weighted sampling -- sampling from a probability density function (PDF) proportional to the product of a base PDF and a weight function -- is a fundamental technique with wide-ranging applications in variance reduction, biased sampling, data augmentation, and more.
The paper introduces KENDO, a unified framework that combines Ensemble Gaussian Processes with disagreement‑aware acquisition strategies to address hyperparameter selection in Bayesian optimization and active learning. By replacing costly hyperparameter sampling with a kernel ensemble and adaptive Bayesian weighting, KENDO‑BO and KENDO‑AL provide self‑correcting mechanisms tailored to their respective tasks. Experiments on synthetic and real‑world benchmarks show that KENDO‑BO matches or outperforms state‑of‑the‑art methods while cutting computational cost up to fivefold, and KENDO‑AL delivers better predictive calibration with up to 27‑times speedup compared to MCMC‑based baselines.
arXiv:2606. 07841v1 Announce Type: cross Abstract: Black-box variational inference (BBVI) is a methodology for posterior approximation that relies on stochastic optimization.
arXiv:2608. 06107v1 Announce Type: new Abstract: Machine learning offers a promising avenue to accelerate physical simulations by replacing computationally expensive traditional Partial Differential Equation (PDE) solvers with fast, differentiable surrogate models.
arXiv:2606. 01468v1 Announce Type: cross Abstract: Due to their explicit priors and ability to model uncertainty, Bayesian methods have played a major role in dynamical latent variable modeling of single-cell neural recordings.
arXiv:2507.06529v2 Announce Type: replace Abstract: Bayesian optimization (BO) is a powerful paradigm for optimizing expensive black-box functions. Traditional BO methods typically rely on separate h...
The paper introduces LB-MCTS, a trajectory-structured optimization framework that combines Monte Carlo Tree Search, Bayesian Optimization, and Large Language Models to address the CASH problem in AutoML. It uses a shared tree state for algorithm selection, hyperparameter refinement, and synergy between BO and LLM proposals, with a reliability-aware policy that shifts from LLM-driven to BO-driven suggestions as the surrogate model improves. Experiments on 104 AMLB datasets show that LB-MCTS consistently outperforms existing BO-based, LLM-based, and hybrid baselines.
The paper introduces Power‑Law Entropy Search (PLES), a computational‑cost‑aware acquisition function that uses multi‑fidelity Bayesian optimization to efficiently estimate optimal hyperparameter scaling laws for large language model training. PLES focuses on reducing the overall uncertainty of scaling law estimates rather than optimizing a single objective, selecting configurations that maximize uncertainty reduction per unit computational cost. Experiments on synthetic benchmarks, surrogate models, and real LLM pre‑training runs show that PLES converges to accurate scaling laws using less than one‑tenth of the computational budget required by conventional grid search and other baselines.
arXiv:2610.18434v2 Announce Type: replace-cross Abstract: Expected improvement based on stochastic kriging (SK) surrogate is widely used in continuous simulation optimization, but unknown heterosceda...
arXiv:2606. 04866v1 Announce Type: new Abstract: Large-scale hyperparameter optimization (HPO) in automated machine learning (AutoML) consumes substantial computational resources, raising growing concerns about scalability and energy efficiency.
arXiv:2609.08620v1 Announce Type: cross Abstract: We address the challenge of scalable uncertainty quantification in large-scale scientific applications, where complex state-of-the-art machine learni...
arXiv:2601. 14430v2 Announce Type: replace-cross Abstract: Controlling generative models is computationally expensive.