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Machine Learning (ML) can help solve combinatorial optimization (CO) problems better. A popular approach is to use a neural net to compute on the parameters of a given CO problem and extract useful information that guides the search for…

Machine Learning · Computer Science 2021-10-27 Yeong-Dae Kwon , Jinho Choo , Iljoo Yoon , Minah Park , Duwon Park , Youngjune Gwon

Most of existing neural methods for multi-objective combinatorial optimization (MOCO) problems solely rely on decomposition, which often leads to repetitive solutions for the respective subproblems, thus a limited Pareto set. Beyond…

Machine Learning · Computer Science 2023-10-25 Jinbiao Chen , Zizhen Zhang , Zhiguang Cao , Yaoxin Wu , Yining Ma , Te Ye , Jiahai Wang

In this article, we present an extension of the formulation recently developed by the authors (A Framework for Data-Driven Computational Mechanics Based on Nonlinear Optimization, arXiv:1910.12736 [math.NA]) to the structural dynamics…

Numerical Analysis · Mathematics 2019-12-25 Cristian Guillermo Gebhardt , Marc Christian Steinbach , Dominik Schillinger , Raimund Rolfes

Traditionally, neural networks are parameterized using optimization procedures such as stochastic gradient descent, RMSProp and ADAM. These procedures tend to drive the parameters of the network toward a local minimum. In this article, we…

Machine Learning · Computer Science 2020-01-07 Benedict Leimkuhler , Charles Matthews , Tiffany Vlaar

Physics-Informed Neural Networks (PINNs) often suffer from slow convergence, training instability, and reduced accuracy on challenging partial differential equations due to the anisotropic and rapidly varying geometry of their loss…

Machine Learning · Computer Science 2026-04-20 Kang An , Chenhao Si , Shiqian Ma , Ming Yan

Numerical methods such as finite element have been flourishing in the past decades for modeling solid mechanics problems via solving governing partial differential equations (PDEs). A salient aspect that distinguishes these numerical…

Numerical Analysis · Mathematics 2020-06-16 Chengping Rao , Hao Sun , Yang Liu

Kinetic equations are crucial for modeling non-equilibrium phenomena, but their computational complexity is a challenge. This paper presents a data-driven approach using reduced order models (ROM) to efficiently model non-equilibrium flows…

Fluid Dynamics · Physics 2023-10-09 Julian Koellermeier , Philipp Krah , Julius Reiss , Zachary Schellin

Training large neural networks (NNs) requires optimizing high-dimensional data-dependent loss functions. The optimization landscape of these functions is often highly complex and textured, even fractal-like, with many spurious local minima,…

Machine Learning · Computer Science 2025-10-27 Mohammed Djameleddine Belgoumri , Mohamed Reda Bouadjenek , Hakim Hacid , Imran Razzak , Sunil Aryal

In this work, we propose a parameter continuation method for the optimization of neural networks. There is a close connection between parameter continuation, homotopies, and curriculum learning. The methods we propose here are theoretically…

Machine Learning · Computer Science 2025-07-31 Harsh Nilesh Pathak , Randy Paffenroth

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

Machine learning for scientific applications faces the challenge of limited data. We propose a framework that leverages a priori known physics to reduce overfitting when training on relatively small datasets. A deep neural network is…

Machine Learning · Computer Science 2019-11-22 Jonathan B. Freund , Jonathan F. MacArt , Justin Sirignano

We formalize the problem of contextual optimization through the lens of Bayesian experimental design and propose CO-BED -- a general, model-agnostic framework for designing contextual experiments using information-theoretic principles.…

Machine Learning · Statistics 2023-07-20 Desi R. Ivanova , Joel Jennings , Tom Rainforth , Cheng Zhang , Adam Foster

The performance of deep (reinforcement) learning systems crucially depends on the choice of hyperparameters. Their tuning is notoriously expensive, typically requiring an iterative training process to run for numerous steps to convergence.…

Machine Learning · Computer Science 2021-01-19 Vu Nguyen , Sebastian Schulze , Michael A Osborne

Physics-Informed Neural Networks (PINNs) have emerged as a powerful framework for solving partial differential equations (PDEs) by embedding physical constraints into the loss function. However, standard optimizers such as Adam often…

Machine Learning · Computer Science 2026-01-22 Vismay Churiwala , Hardik Shukla , Manurag Khullar

Deep neural networks (DNNs) are powerful machine learning models and have succeeded in various artificial intelligence tasks. Although various architectures and modules for the DNNs have been proposed, selecting and designing the…

Neural and Evolutionary Computing · Computer Science 2018-01-24 Shinichi Shirakawa , Yasushi Iwata , Youhei Akimoto

Simulation Optimization (SO) refers to the optimization of an objective function subject to constraints, both of which can be evaluated through a stochastic simulation. To address specific features of a particular simulation---discrete or…

Data Structures and Algorithms · Computer Science 2017-06-28 Satyajith Amaran , Nikolaos V. Sahinidis , Bikram Sharda , Scott J. Bury

This paper investigates the optimization of the long-standing probabilistically robust transmit beamforming problem with channel uncertainties in the multiuser multiple-input single-output (MISO) downlink transmission. This problem poses…

Information Theory · Computer Science 2024-06-06 Kai Liang , Gan Zheng , Zan Li , Kai-Kit Wong , Chan-Byoung Chae

Artificial neural networks have gone through a recent rise in popularity, achieving state-of-the-art results in various fields, including image classification, speech recognition, and automated control. Both the performance and…

Neural and Evolutionary Computing · Computer Science 2016-11-08 Sean C. Smithson , Guang Yang , Warren J. Gross , Brett H. Meyer

An algorithm is presented for momentum gradient descent optimization based on the first-order differential equation of the Newtonian dynamics. The fictitious mass is introduced to the dynamics of momentum for regularizing the adaptive…

Machine Learning · Computer Science 2018-05-15 Zhidong Han

The impressive progress of the kinetic schemes in the solution of gas dynamics problems and the development of effective parallel algorithms for modern high performance parallel computing systems led to the development of advanced methods…

Plasma Physics · Physics 2013-05-06 B. Chetverushkin , N. D'Ascenzo , V. Saveliev