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Modeling of physical systems includes extensive use of software packages that implement the accurate finite element method for solving differential equations considered along with the appropriate initial and boundary conditions. When the…

计算工程、金融与科学 · 计算机科学 2018-03-20 O. Kononenko , I. Kononenko

Simulation and modeling are essential in product development, integrated into the design and manufacturing process to enhance efficiency and quality. They are typically represented as complex nonlinear differential algebraic equations. The…

机器学习 · 计算机科学 2026-03-25 Wenqiang Yang , Wenyuan Wu , Yong Feng , Changbo Chen

Computer models, aiming at simulating a complex real system, are often calibrated in the light of data to improve performance. Standard calibration methods assume that the optimal values of calibration parameters are invariant to the model…

统计方法学 · 统计学 2017-09-01 Georgios Karagiannis , Bledar A. Konomi , Guang Lin

The design of fusion devices is typically based on computationally expensive simulations. This can be alleviated using high aspect ratio models that employ a reduced number of free parameters, especially in the case of stellarator…

等离子体物理 · 物理学 2025-02-26 P. Curvo , D. R. Ferreira , R. Jorge

Machine learning assumes a pivotal role in our data-driven world. The increasing scale of models and datasets necessitates quick and reliable algorithms for model training. This dissertation investigates adaptivity in machine learning…

机器学习 · 计算机科学 2023-11-20 Slavomír Hanzely

Robust model fitting is a core algorithm in a large number of computer vision applications. Solving this problem efficiently for datasets highly contaminated with outliers is, however, still challenging due to the underlying computational…

计算机视觉与模式识别 · 计算机科学 2021-03-08 Giang Truong , Huu Le , David Suter , Erchuan Zhang , Syed Zulqarnain Gilani

An important field in robotics is the optimization of controllers. Currently, robots are often treated as a black box in this optimization process, which is the reason why derivative-free optimization methods such as evolutionary algorithms…

神经与进化计算 · 计算机科学 2018-11-27 Jonas Degrave , Michiel Hermans , Joni Dambre , Francis wyffels

Reconstructing force fields (FFs) from atomistic simulation data is a challenge since accurate data can be highly expensive. Here, machine learning (ML) models can help to be data economic as they can be successfully constrained using the…

化学物理 · 物理学 2022-10-27 Niklas Frederik Schmitz , Klaus-Robert Müller , Stefan Chmiela

We study optimization algorithms for the finite sum problems frequently arising in machine learning applications. First, we propose novel variants of stochastic gradient descent with a variance reduction property that enables linear…

机器学习 · 计算机科学 2017-07-06 Jakub Konečný

Many applications, especially in physics and other sciences, call for easily interpretable and robust machine learning techniques. We propose a fully gradient-based technique for training radial basis function networks with an efficient and…

机器学习 · 计算机科学 2022-09-30 Jussi Määttä , Viacheslav Bazaliy , Jyri Kimari , Flyura Djurabekova , Kai Nordlund , Teemu Roos

Federated Learning (FL) decouples model training from the need for direct access to the data and allows organizations to collaborate with industry partners to reach a satisfying level of performance without sharing vulnerable business…

We consider the task of training machine learning models with data-dependent constraints. Such constraints often arise as empirical versions of expected value constraints that enforce fairness or stability goals. We reformulate…

机器学习 · 统计学 2023-01-18 Songkai Xue , Yuekai Sun , Mikhail Yurochkin

Deep neural networks (DNNs) depend on the storage of a large number of parameters, which consumes an important portion of the energy used during inference. This paper considers the case where the energy usage of memory elements can be…

机器学习 · 计算机科学 2019-12-24 Sébastien Henwood , François Leduc-Primeau , Yvon Savaria

We study a budgeted hyper-parameter tuning problem, where we optimize the tuning result under a hard resource constraint. We propose to solve it as a sequential decision making problem, such that we can use the partial training progress of…

机器学习 · 计算机科学 2019-02-05 Zhiyun Lu , Chao-Kai Chiang , Fei Sha

In system analysis and design optimization, multiple computational models are typically available to represent a given physical system. These models can be broadly classified as high-fidelity models, which provide highly accurate…

机器学习 · 计算机科学 2024-11-01 Ruda Zhang , Negin Alemazkoor

This paper presents a methodological framework for training, self-optimising, and self-organising surrogate models to approximate and speed up multiobjective optimisation of technical systems based on multiphysics simulations. At the hand…

Aerodynamic shape optimization in industry still faces challenges related to robustness and scalability. This aspect becomes crucial for advanced optimizations that rely on expensive high-fidelity flow solvers, where computational budget…

流体动力学 · 物理学 2025-05-26 Marc Schouler , Anca Belme , Paola Cinnella

Many scientific and engineering applications require fitting regression models that are nonlinear in the parameters. Advances in computer hardware and software in recent decades have made it easier to fit such models. Relative to fitting…

统计方法学 · 统计学 2024-03-20 Peng Liu , William Q. Meeker

Hyperparameter selection generally relies on running multiple full training trials, with selection based on validation set performance. We propose a gradient-based approach for locally adjusting hyperparameters during training of the model.…

机器学习 · 计算机科学 2016-06-20 Jelena Luketina , Mathias Berglund , Klaus Greff , Tapani Raiko

Density Functional Theory (DFT) allows for predicting all the chemical and physical properties of molecular systems from first principles by finding an approximate solution to the many-body Schr\"odinger equation. However, the cost of these…

机器学习 · 计算机科学 2025-06-03 Majdi Hassan , Cristian Gabellini , Hatem Helal , Dominique Beaini , Kirill Neklyudov