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Projection-based model reduction has become a popular approach to reduce the cost associated with integrating large-scale dynamical systems so they can be used in many-query settings such as optimization and uncertainty quantification. For…

数值分析 · 数学 2020-08-26 Han Gao , Jian-Xun Wang , Matthew J. Zahr

The core objective of machine-assisted scientific discovery is to learn physical laws from experimental data without prior knowledge of the systems in question. In the area of quantum physics, making progress towards these goals is…

量子物理 · 物理学 2023-01-09 Matthew Choi , Daniel Flam-Shepherd , Thi Ha Kyaw , Alán Aspuru-Guzik

Deep learning is the backbone of artificial intelligence technologies, and it can be regarded as a kind of multilayer feedforward neural network. An essence of deep learning is information propagation through layers. This suggests that…

神经与进化计算 · 计算机科学 2021-04-02 Genki Furuhata , Tomoaki Niiyama , Satoshi Sunada

Most popular optimizers for deep learning can be broadly categorized as adaptive methods (e.g. Adam) and accelerated schemes (e.g. stochastic gradient descent (SGD) with momentum). For many models such as convolutional neural networks…

Differential equations in general and neural ODEs in particular are an essential technique in continuous-time system identification. While many deterministic learning algorithms have been designed based on numerical integration via the…

机器学习 · 计算机科学 2021-10-18 Lenart Treven , Philippe Wenk , Florian Dörfler , Andreas Krause

Discrete gradient methods are a powerful tool for the time discretization of dynamical systems, since they are structure-preserving regardless of the form of the total energy. In this work, we discuss the application of discrete gradient…

数值分析 · 数学 2026-01-06 Philipp L. Kinon , Riccardo Morandin , Philipp Schulze

We propose an inference procedure for deep convolutional neural networks (CNNs) when partial evidence is available. Our method consists of a general feedback-based propagation approach (feedback-prop) that boosts the prediction accuracy for…

计算机视觉与模式识别 · 计算机科学 2018-04-02 Tianlu Wang , Kota Yamaguchi , Vicente Ordonez

Stochastic gradient descent is the method of choice for large scale optimization of machine learning objective functions. Yet, its performance is greatly variable and heavily depends on the choice of the stepsizes. This has motivated a…

机器学习 · 统计学 2019-02-28 Xiaoyu Li , Francesco Orabona

We present EPR-Net, a novel and effective deep learning approach that tackles a crucial challenge in biophysics: constructing potential landscapes for high-dimensional non-equilibrium steady-state (NESS) systems. EPR-Net leverages a nice…

生物物理 · 物理学 2024-04-10 Yue Zhao , Wei Zhang , Tiejun Li

Stochastic gradient descent (SGD) is a promising method for solving large-scale inverse problems, due to its excellent scalability with respect to data size. In this work, we analyze a new data-driven regularized stochastic gradient descent…

数值分析 · 数学 2024-09-30 Zehui Zhou

Deep neural networks (DNN) have been used to model nonlinear relations between physical quantities. Those DNNs are embedded in physical systems described by partial differential equations (PDE) and trained by minimizing a loss function that…

数值分析 · 数学 2020-02-26 Kailai Xu , Eric Darve

Modeling the dynamics of open quantum systems on noisy intermediate-scale quantum (NISQ) devices constitutes a major challenge, as high noise levels and environmental degradations lead to the decay of pure quantum states (decoherence) and…

量子物理 · 物理学 2026-01-26 Aleyna Ceyran , Jair Minoro Abe

Neural networks trained with backpropagation, the standard algorithm of deep learning which uses weight transport, are easily fooled by existing gradient-based adversarial attacks. This class of attacks are based on certain small…

机器学习 · 计算机科学 2019-10-04 Mohamed Akrout

We propose a stochastic projection-based gradient free physics-informed neural network. The proposed approach, referred to as the stochastic projection based physics informed neural network (SP-PINN), blends upscaled stochastic projection…

计算工程、金融与科学 · 计算机科学 2022-09-29 Navaneeth N , Souvik Chakraborty

We introduce the Backwards Quantum Propagation of Phase errors (Baqprop) principle, a central theme upon which we construct multiple universal optimization heuristics for training both parametrized quantum circuits and classical deep neural…

量子物理 · 物理学 2018-06-27 Guillaume Verdon , Jason Pye , Michael Broughton

Adaptive Gradient Descent with Energy (AEGD) is a variant of gradient descent (GD) designed to mitigate step-size sensitivity through an energy-based formulation. AEGD is notable for its unconditional energy stability, which guarantees…

最优化与控制 · 数学 2025-12-16 Lin Feng , Hailiang Liu

This paper presents a deep learning strategy to simultaneously solve Partial Differential Equations (PDEs) and back-calculate their parameters in the context of deep tunnel excavation. A Physics-Informed Neural Network (PINN) model is…

计算物理 · 物理学 2026-05-29 Alec Tristani , Chloé Arson

The Backpropagation algorithm relies on the abstraction of using a neural model that gets rid of the notion of time, since the input is mapped instantaneously to the output. In this paper, we claim that this abstraction of ignoring time,…

机器学习 · 计算机科学 2020-06-19 Alessandro Betti , Marco Gori

We learn recurrent neural network optimizers trained on simple synthetic functions by gradient descent. We show that these learned optimizers exhibit a remarkable degree of transfer in that they can be used to efficiently optimize a broad…

We propose SymDiff, a method for constructing equivariant diffusion models using the framework of stochastic symmetrisation. SymDiff resembles a learned data augmentation that is deployed at sampling time, and is lightweight,…

机器学习 · 计算机科学 2025-03-04 Leo Zhang , Kianoosh Ashouritaklimi , Yee Whye Teh , Rob Cornish
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