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Hyperparameter optimization (HPO) is critical for enhancing the performance of machine learning models, yet it often involves a computationally intensive search across a large parameter space. Traditional approaches such as Grid Search and…

Machine Learning · Computer Science 2024-12-24 Md. Tarek Hasan

Heuristic optimisation algorithms explore the search space by sampling solutions, evaluating their fitness, and biasing the search in the direction of promising solutions. However, in many cases, this fitness function involves executing…

Neural and Evolutionary Computing · Computer Science 2024-10-07 Pablo S. Naharro , Pablo Toharia , Antonio LaTorre , José-María Peña

Developing surrogates for computer models has become increasingly important for addressing complex problems in science and engineering. This article introduces an artificial intelligent (AI) surrogate, referred to as the DeepSurrogate, for…

Stability arguments are often used to prevent learning algorithms from having ever increasing activity and weights that hinder generalization. However, stability conditions can clash with the sparsity required to augment the energy…

Neural and Evolutionary Computing · Computer Science 2024-01-08 Luca Herranz-Celotti , Jean Rouat

Particle accelerators are enabling tools for scientific exploration and discovery in various disciplines. Finding optimized operation points for these complex machines is a challenging task, however, due to the large number of parameters…

Accelerator Physics · Physics 2021-07-02 Renato Bellotti , Romana Boiger , Andreas Adelmann

Learned optimizers -- neural networks that are trained to act as optimizers -- have the potential to dramatically accelerate training of machine learning models. However, even when meta-trained across thousands of tasks at huge…

Machine Learning · Computer Science 2022-09-23 James Harrison , Luke Metz , Jascha Sohl-Dickstein

Traditional maximum entropy and sparsity-based algorithms for analytic continuation often suffer from the ill-posed kernel matrix or demand tremendous computation time for parameter tuning. Here we propose a neural network method by convex…

Machine Learning · Computer Science 2022-02-07 Dongchen Huang , Yi-feng Yang

In recent years, the use of machine learning-based surrogate models for computational fluid dynamics (CFD) simulations has emerged as a promising technique for reducing the computational cost associated with engine design optimization.…

We propose a novel method for gradient-based optimization of black-box simulators using differentiable local surrogate models. In fields such as physics and engineering, many processes are modeled with non-differentiable simulators with…

Machine Learning · Computer Science 2020-09-30 Sergey Shirobokov , Vladislav Belavin , Michael Kagan , Andrey Ustyuzhanin , Atılım Güneş Baydin

Several tasks in machine learning are evaluated using non-differentiable metrics such as mean average precision or Spearman correlation. However, their non-differentiability prevents from using them as objective functions in a learning…

Machine Learning · Computer Science 2019-04-10 Martin Engilberge , Louis Chevallier , Patrick Pérez , Matthieu Cord

Neural networks (NN)-based learning algorithms are strongly affected by the choices of initialization and data distribution. Different optimization strategies have been proposed for improving the learning trajectory and finding a better…

Machine Learning · Computer Science 2021-03-19 Yimeng Min

In satellite layout design, heat source layout optimization (HSLO) is an effective technique to decrease the maximum temperature and improve the heat management of the whole system. Recently, deep learning surrogate assisted HSLO has been…

Neural and Evolutionary Computing · Computer Science 2022-07-05 Jialiang Sun , Xiaohu Zheng , Wen Yao , Xiaoya Zhang , Weien Zhou , Xiaoqian Chen

We analyze the convergence of gradient-based optimization algorithms that base their updates on delayed stochastic gradient information. The main application of our results is to the development of gradient-based distributed optimization…

Optimization and Control · Mathematics 2011-05-02 Alekh Agarwal , John C. Duchi

Hardware-aware Neural Architecture Search (NAS) is one of the most promising techniques for designing efficient Deep Neural Networks (DNNs) for resource-constrained devices. Surrogate models play a crucial role in hardware-aware NAS as they…

Machine Learning · Computer Science 2025-08-05 Azaz-Ur-Rehman Nasir , Samroz Ahmad Shoaib , Muhammad Abdullah Hanif , Muhammad Shafique

The architectural advancements in deep neural networks have led to remarkable leap-forwards across a broad array of computer vision tasks. Instead of relying on human expertise, neural architecture search (NAS) has emerged as a promising…

Computer Vision and Pattern Recognition · Computer Science 2022-08-16 Zhichao Lu , Ran Cheng , Shihua Huang , Haoming Zhang , Changxiao Qiu , Fan Yang

Stochastic Gradient Descent (SGD) has proven to be remarkably effective in optimizing deep neural networks that employ ever-larger numbers of parameters. Yet, improving the efficiency of large-scale optimization remains a vital and highly…

Machine Learning · Computer Science 2020-11-11 Frithjof Gressmann , Zach Eaton-Rosen , Carlo Luschi

We present a novel active learning algorithm, termed as iterative surrogate model optimization (ISMO), for robust and efficient numerical approximation of PDE constrained optimization problems. This algorithm is based on deep neural…

Optimization and Control · Mathematics 2020-12-30 Kjetil O. Lye , Siddhartha Mishra , Deep Ray , Praveen Chandrasekhar

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

Gradient-based optimization has been critical to the success of machine learning, updating a single set of parameters to minimize a single loss. A growing number of applications rely on a generalization of this, where we have a bilevel or…

Machine Learning · Computer Science 2024-07-02 Jonathan Lorraine

High-fidelity numerical simulation of subsurface flow is computationally intensive, especially for many-query tasks such as uncertainty quantification and data assimilation. Deep learning (DL) surrogates can significantly accelerate forward…

Machine Learning · Computer Science 2026-04-15 Jiale Liu , Nanzhe Wang
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