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Replica exchange stochastic gradient Langevin dynamics (reSGLD) is an effective sampler for non-convex learning in large-scale datasets. However, the simulation may encounter stagnation issues when the high-temperature chain delves too…

Machine Learning · Computer Science 2024-06-04 Haoyang Zheng , Hengrong Du , Qi Feng , Wei Deng , Guang Lin

A Riemannian stochastic representation of model uncertainties in molecular dynamics is proposed. The approach relies on a reduced-order model, the projection basis of which is randomized on a subset of the Stiefel manifold characterized by…

Computational Physics · Physics 2022-10-27 Hao Zhang , Johann Guilleminot

Graphs are ubiquitous, and learning on graphs has become a cornerstone in artificial intelligence and data mining communities. Unlike pixel grids in images or sequential structures in language, graphs exhibit a typical non-Euclidean…

Machine Learning · Computer Science 2026-02-12 Li Sun , Qiqi Wan , Suyang Zhou , Zhenhao Huang , Philip S. Yu

It is known that some equations of differential geometry are derived from variational principle in form of Euler-Lagrange equations. The equations of geodesic flow in Riemannian geometry is an example. Conversely, having Lagrangian…

Differential Geometry · Mathematics 2007-05-23 Ruslan Sharipov

Lagrangian averaging theories, most notably the Generalised Lagrangian Mean (GLM) theory of Andrews & McIntyre (1978), have been primarily developed in Euclidean space and Cartesian coordinates. We re-interpret these theories using a…

Fluid Dynamics · Physics 2024-05-08 Andrew D. Gilbert , Jacques Vanneste

We introduce Riemannian Lie algebroids as a generalization of Riemannian manifolds and we show that most of the classical tools and results known in Riemannian geometry can be stated in this setting. We give also some new results on the…

Differential Geometry · Mathematics 2008-08-29 Mohamed Boucetta

We study a minimal non-Markovian model of superdiffusion which originates from long-range velocity correlations within the generalized Langevin equation (GLE) approach. The model allows for a three-dimensional Markovian embedding. The…

Statistical Mechanics · Physics 2015-05-19 P. Siegle , I. Goychuk , P. Hanggi

Under the data manifold hypothesis, high-dimensional data are concentrated near a low-dimensional manifold. We study the problem of Riemannian optimization over such manifolds when they are given only implicitly through the data…

Machine Learning · Computer Science 2026-03-03 Andrey Kharitenko , Zebang Shen , Riccardo de Santi , Niao He , Florian Doerfler

Riemannian geometry provides the fundamental framework for optimization on nonlinear spaces such as matrix manifolds, which arise in machine learning, signal processing, and robotics. While the underlying theory is classical, existing…

Differential Geometry · Mathematics 2026-05-05 Benyamin Ghojogh

Distributed order fractional Langevin-like equations are introduced and applied to describe anomalous diffusion without unique diffusion or scaling exponent. It is shown that these fractional Langevin equations of distributed order can be…

Statistical Mechanics · Physics 2012-01-16 C. H. Eab , S. C. Lim

This article provides an expository account of training dynamics in the Deep Linear Network (DLN) from the perspective of the geometric theory of dynamical systems. Rigorous results by several authors are unified into a thermodynamic…

Neural and Evolutionary Computing · Computer Science 2024-11-15 Govind Menon

We introduce a novel class of score-based diffusion processes that operate directly in the representation space of Lie groups. Leveraging the framework of Generalized Score Matching, we derive a class of Langevin dynamics that decomposes as…

Machine Learning · Computer Science 2025-10-28 Marco Bertolini , Tuan Le , Djork-Arné Clevert

Pervasive across diverse domains, stochastic systems exhibit fluctuations in processes ranging from molecular dynamics to climate phenomena. The Langevin equation has served as a common mathematical model for studying such systems, enabling…

Statistical Mechanics · Physics 2025-05-01 Youngkyoung Bae , Seungwoong Ha , Hawoong Jeong

Diffusion and flow models have become the dominant paradigm for generative modeling on Riemannian manifolds, with successful applications in protein backbone generation and DNA sequence design. However, these methods require tens to…

Machine Learning · Computer Science 2026-05-04 Dongyeop Woo , Marta Skreta , Seonghyun Park , Kirill Neklyudov , Sungsoo Ahn

In recent years, stochastic variance reduction algorithms have attracted considerable attention for minimizing the average of a large but finite number of loss functions. This paper proposes a novel Riemannian extension of the Euclidean…

Machine Learning · Computer Science 2019-06-03 Hiroyuki Sato , Hiroyuki Kasai , Bamdev Mishra

Stochastic Gradient Langevin Dynamics (SGLD) is a popular variant of Stochastic Gradient Descent, where properly scaled isotropic Gaussian noise is added to an unbiased estimate of the gradient at each iteration. This modest change allows…

Machine Learning · Computer Science 2017-06-06 Maxim Raginsky , Alexander Rakhlin , Matus Telgarsky

We propose a framework for solving evolution equations within parametric function classes, especially ones that are specified by neural networks. We call this framework the minimal neural evolution (MNE) because it is motivated by the goal…

Numerical Analysis · Mathematics 2025-02-07 Michael Lindsey

For reproducing the anomalous -- i.e., sub- or super-diffusive -- behavior in some stochastic dynamical systems, the Generalized Langevin Equation (GLE) has gained considerable popularity in recent years. Motivated by the question whether…

Soft Condensed Matter · Physics 2010-02-05 Debabrata Panja

We use geometric invariant theory (GIT) to study the deep linear network (DLN). The Kempf-Ness theorem is used to establish that the $L^2$ regularizer is minimized on the balanced manifold. We introduce related balancing flows using the…

Machine Learning · Computer Science 2026-03-24 Kathryn Lindsey , Govind Menon

Capturing the correct dynamics at the Coarse-Grained (CG) scale remains a central challenge in the advancement of systematic CG models for soft matter simulations. The Generalized Langevin Equation (GLE), rooted in the Mori-Zwanzig…

Soft Condensed Matter · Physics 2024-10-14 Jinu Jeong , Ishan Nadkarni , Narayana. R. Aluru