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This work proposes a framework for large-scale stochastic derivative-free optimization (DFO) by introducing STARS, a trust-region method based on iterative minimization in random subspaces. This framework is both an algorithmic and…

Optimization and Control · Mathematics 2024-09-26 Kwassi Joseph Dzahini , Stefan M. Wild

Active multi-fidelity surrogate modeling is developed for multi-condition airfoil shape optimization to reduce high-fidelity CFD cost while retaining RANS-level accuracy. The framework couples a low-fidelity-informed Gaussian process…

We propose Hermite-NGP, a gradient-augmented multi-resolution hash encoding designed to enable fast and accurate computation of spatial derivatives for neural PDE solvers. Unlike existing NGP-based approaches that rely on automatic…

Machine Learning · Computer Science 2026-05-26 Jinjin He , Zhiqi Li , Sinan Wang , Bo Zhu

The development of a reliable and robust surrogate model is often constrained by the dimensionality of the problem. For a system with high-dimensional inputs/outputs (I/O), conventional approaches usually use a low-dimensional manifold to…

Image and Video Processing · Electrical Eng. & Systems 2020-10-01 Xihaier Luo , Ahsan Kareem

Despite the recent progress in hyperparameter optimization (HPO), available benchmarks that resemble real-world scenarios consist of a few and very large problem instances that are expensive to solve. This blocks researchers and…

Machine Learning · Computer Science 2019-11-26 Aaron Klein , Zhenwen Dai , Frank Hutter , Neil Lawrence , Javier Gonzalez

Complexity analysis has become an important tool in the convergence analysis of optimization algorithms. For derivative-free optimization algorithms, it is not different. Interestingly, several constants that appear when developing…

Optimization and Control · Mathematics 2024-09-26 A. E. Schwertner , F. N. C. Sobral

We present a framework for smooth optimization of explicitly regularized objectives for (structured) sparsity. These non-smooth and possibly non-convex problems typically rely on solvers tailored to specific models and regularizers. In…

Machine Learning · Computer Science 2026-04-09 Chris Kolb , Christian L. Müller , Bernd Bischl , David Rügamer

The kernel herding algorithm is used to construct quadrature rules in a reproducing kernel Hilbert space (RKHS). While the computational efficiency of the algorithm and stability of the output quadrature formulas are advantages of this…

Numerical Analysis · Mathematics 2022-07-18 Kazuma Tsuji , Ken'ichiro Tanaka

Gradient-based optimization is now ubiquitous across graphics, but unfortunately can not be applied to problems with undefined or zero gradients. To circumvent this issue, the loss function can be manually replaced by a ``surrogate'' that…

Computer Vision and Pattern Recognition · Computer Science 2024-05-08 Michael Fischer , Tobias Ritschel

This paper introduces a comprehensive open-source framework for developing correlation kernels, with a particular focus on user-defined and composition of kernels for surrogate modeling. By advancing kernel-based modeling techniques, we…

Machine Learning · Computer Science 2025-07-15 Nicolas Gonel , Paul Saves , Joseph Morlier

Policy gradient methods for Large Language Models optimize a policy $\pi_\theta$ via a surrogate objective computed from samples of a rollout policy $\pi_{\text{roll}}$. However, modern LLM-RL pipelines suffer from unavoidable…

Machine Learning · Computer Science 2026-03-02 Yingru Li , Jiacai Liu , Jiawei Xu , Yuxuan Tong , Ziniu Li , Qian Liu , Baoxiang Wang

Non-monotone trust-region methods are known to provide additional benefits for scalar and multi-objective optimization, such as enhancing the probability of convergence and improving the speed of convergence. For optimization of set-valued…

Optimization and Control · Mathematics 2025-09-24 Suprova Ghosh , Debdas Ghosh , Zai-Yun Peng , Xian-Jun Long

Stochastic gradient descent algorithms for training linear and kernel predictors are gaining more and more importance, thanks to their scalability. While various methods have been proposed to speed up their convergence, the model selection…

Machine Learning · Computer Science 2014-06-17 Francesco Orabona

Modern approaches for simulation-based inference rely upon deep learning surrogates to enable approximate inference with computer simulators. In practice, the estimated posteriors' computational faithfulness is, however, rarely guaranteed.…

Machine Learning · Statistics 2022-08-30 Arnaud Delaunoy , Joeri Hermans , François Rozet , Antoine Wehenkel , Gilles Louppe

Accurate interpolation of functions and derivatives is crucial in solving partial differential equations (PDEs). The Radial Basis Function (RBF) method has become an extremely popular and robust approach for interpolation on scattered data.…

Numerical Analysis · Mathematics 2025-05-23 Amirhossein Fashamiha , David Salac

Carefully designed activation functions can improve the performance of neural networks in many machine learning tasks. However, it is difficult for humans to construct optimal activation functions, and current activation function search…

Machine Learning · Computer Science 2023-11-10 Garrett Bingham , Risto Miikkulainen

We study distributed multiagent optimization over (directed, time-varying) graphs. We consider the minimization of $F+G$ subject to convex constraints, where $F$ is the smooth strongly convex sum of the agent's losses and $G$ is a nonsmooth…

Optimization and Control · Mathematics 2020-10-13 Ying Sun , Amir Daneshmand , Gesualdo Scutari

Biophysical neural system simulations are among the most computationally demanding scientific applications, and their optimization requires navigating high-dimensional parameter spaces under numerous constraints that impose a binary…

Model extraction attacks have become serious issues for service providers using machine learning. We consider an adversarial setting to prevent model extraction under the assumption that attackers will make their best guess on the service…

Machine Learning · Computer Science 2021-03-12 Yuto Mori , Atsushi Nitanda , Akiko Takeda

Inspired by multi-fidelity methods in computer simulations, this article introduces procedures to design surrogates for the input/output relationship of a high-fidelity code. These surrogates should be learned from runs of both the…

Numerical Analysis · Mathematics 2024-06-21 Simon Foucart , Nicolas Hengartner
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