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Molecular Dynamics (MD) simulations provide a fundamental tool for characterizing molecular behavior at full atomic resolution, but their applicability is severely constrained by the computational cost. To address this, a surge of deep…

Machine Learning · Computer Science 2026-03-02 Ziyang Yu , Wenbing Huang , Yang Liu

We consider the dynamics of a microswimmer and show that they can be approximated by active Brownian motion. The swimmer is modeled by coupled overdamped Langevin equations with periodic driving. We compare the energy dissipation of the…

Statistical Mechanics · Physics 2019-01-16 Jannik Ehrich , Marcel Kahlen

While humans effortlessly discern intrinsic dynamics and adapt to new scenarios, modern AI systems often struggle. Current methods for visual grounding of dynamics either use pure neural-network-based simulators (black box), which may…

Computer Vision and Pattern Recognition · Computer Science 2024-10-14 Junyi Cao , Shanyan Guan , Yanhao Ge , Wei Li , Xiaokang Yang , Chao Ma

It is generally thought that the use of stochastic activation functions in deep learning architectures yield models with superior generalization abilities. However, a sufficiently rigorous statement and theoretical proof of this heuristic…

Machine Learning · Computer Science 2024-06-25 Sriram Nagaraj , Truman Hickok

The modeling of complex reaction-diffusion processes in, for instance, cellular biochemical networks or self-assembling soft matter can be tremendously sped up by employing a multiscale algorithm which combines the mesoscopic Green's…

Molecular Networks · Quantitative Biology 2017-04-05 Adithya Vijaykumar , Thomas E. Ouldridge , Pieter Rein ten Wolde , Peter G. Bolhuis

We develop a general optimization-theoretic framework for Bregman-Variational Learning Dynamics (BVLD), a new class of operator-based updates that unify Bayesian inference, mirror descent, and proximal learning under time-varying…

Optimization and Control · Mathematics 2025-10-24 Jinho Cha , Youngchul Kim , Jungmin Shin , Jaeyoung Cho , Seon Jin Kim , Junyeol Ryu

In this paper numerical methods for solving stochastic differential equations with Markovian switching (SDEwMSs) are developed by pathwise approximation. The proposed family of strong predictor-corrector Euler-Maruyama methods is designed…

Numerical Analysis · Mathematics 2011-03-08 Jun Ye , Haibo Li , Lili Xiao

Brownian motion in confinement and at interfaces is a canonical situation, encountered from fundamental biophysics to nanoscale engineering. Using the Lorenz-Mie framework, we optically record the thermally-induced tridimensional…

Soft Condensed Matter · Physics 2021-07-14 Maxime Lavaud , Thomas Salez , Yann Louyer , Yacine Amarouchene

We give a new take on the error analysis of approximations of stochastic differential equations (SDEs), utilizing and developing the stochastic sewing lemma of L\^e (2020). This approach allows one to exploit regularization by noise effects…

Probability · Mathematics 2021-08-10 Oleg Butkovsky , Konstantinos Dareiotis , Máté Gerencsér

Neural networks (NNs) that exploit strong inductive biases based on physical laws and symmetries have shown remarkable success in learning the dynamics of physical systems directly from their trajectory. However, these works focus only on…

Machine Learning · Computer Science 2023-06-21 Suresh Bishnoi , Jayadeva , Sayan Ranu , N. M. Anoop Krishnan

The Malliavin differentiability of a SDE plays a crucial role in the study of density smoothness and ergodicity among others. For Gaussian driven SDEs the differentiability property is now well established. In this paper, we consider the…

Probability · Mathematics 2023-05-18 Jorge A. León , Yanghui Liu , Samy Tindel

We discuss recent advances in developing a mode-coupling theory of the glass transition (MCT) of two-dimensional systems of active Brownian particles (ABP). We specifically discuss the case of a single ABP tracer in a glass-forming passive…

Soft Condensed Matter · Physics 2020-12-15 Julian Reichert , Leon Granz , Thomas Voigtmann

In this paper, we will present a strong (or pathwise) approximation of standard Brownian motion by a class of orthogonal polynomials. The coefficients that are obtained from the expansion of Brownian motion in this polynomial basis are…

Numerical Analysis · Mathematics 2020-05-21 James Foster , Terry Lyons , Harald Oberhauser

We consider one-step methods for integrating stochastic differential equations and prove pathwise convergence using ideas from rough path theory. In contrast to alternative theories of pathwise convergence, no knowledge is required of…

Numerical Analysis · Mathematics 2015-02-24 Tony Shardlow , Phillip Taylor

In this work, we examine a spectrum of hybrid model for the domain of multi-body robot dynamics. We motivate a computation graph architecture that embodies the Newton Euler equations, emphasizing the utility of the Lie Algebra form in…

Robotics · Computer Science 2020-10-21 Michael Lutter , Johannes Silberbauer , Joe Watson , Jan Peters

The last few years have witnessed an explosion of new numerical methods for filament hydrodynamics. Aside from their ubiquity in biology, physics, and engineering, filaments present unique challenges from an applied-mathematical point of…

Numerical Analysis · Mathematics 2024-11-21 Ondrej Maxian , Aleksandar Donev

The rate of strong convergence is investigated for an approximation scheme for a class of stochastic differential equations driven by a time-changed Brownian motion, where the random time changes $(E_t)_{t\ge 0}$ considered include the…

Probability · Mathematics 2020-03-02 Sixian Jin , Kei Kobayashi

In this article, we present a general methodology for stochastic control problems driven by the Brownian motion filtration including non-Markovian and non-semimartingale state processes controlled by mutually singular measures. The main…

Probability · Mathematics 2024-04-04 Dorival Leão , Alberto Ohashi , Francys Andrews de Souza

We present an exact solution for one-dimensional overdamped dynamics near a hard wall, allowing us to connect steady-state distributions under confinement with the extreme value statistics of unconfined stochastic processes. This mapping…

Statistical Mechanics · Physics 2024-11-05 Thibaut Arnoulx de Pirey

Dynamical systems with high intrinsic dimensionality are often characterized by extreme events having the form of rare transitions several standard deviations away from the mean. For such systems, order-reduction methods through projection…

Chaotic Dynamics · Physics 2018-07-04 Zhong Yi Wan , Pantelis R. Vlachas , Petros Koumoutsakos , Themistoklis P. Sapsis