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We develop a machine-learning method for coarse-graining condensed-phase molecular systems using anisotropic particles. The method extends currently available high-dimensional neural network potentials by addressing molecular anisotropy. We…

Statistical Mechanics · Physics 2023-07-12 Marltan O. Wilson , David M. Huang

The study of the rare transitions that take place between long lived metastable states is a major challenge in molecular dynamics simulations. Many of the methods suggested to address this problem rely on the identification of the slow…

Chemical Physics · Physics 2023-06-07 Dhiman Ray , Enrico Trizio , Michele Parrinello

This paper introduces a novel methodology for solving distributed-order fractional differential equations using a physics-informed machine learning framework. The core of this approach involves extending the support vector regression (SVR)…

Machine Learning · Computer Science 2024-09-06 Alireza Afzal Aghaei

Estimating the outcome of a given dynamical process from structural features is a key unsolved challenge in network science. The goal is hindered by difficulties associated to nonlinearities, correlations and feedbacks between the structure…

Physics and Society · Physics 2019-10-02 Francisco A. Rodrigues , Thomas Peron , Colm Connaughton , Jurgen Kurths , Yamir Moreno

We address a numerical methodology for the computation of coarse-grained stable and unstable manifolds of saddle equilibria/stationary states of multiscale/stochastic systems for which a "good" macroscopic description in the form of…

Dynamical Systems · Mathematics 2019-09-10 Constantinos Siettos , Lucia Russo

We investigate recurrent neural networks with asymmetric interactions and demonstrate that the inclusion of self-couplings or sparse excitatory inter-module connections leads to the emergence of a densely connected manifold of dynamically…

Disordered Systems and Neural Networks · Physics 2026-01-01 Davide Badalotti , Carlo Baldassi , Marc Mézard , Mattia Scardecchia , Riccardo Zecchina

The order/dimension of models derived on the basis of data is commonly restricted by the number of observations, or in the context of monitored systems, sensing nodes. This is particularly true for structural systems (e.g., civil or…

Machine Learning · Computer Science 2022-12-01 Zhilu Lai , Wei Liu , Xudong Jian , Kiran Bacsa , Limin Sun , Eleni Chatzi

Complex systems in science and engineering sometimes exhibit behavior that changes across different regimes. Traditional global models struggle to capture the full range of this complex behavior, limiting their ability to accurately…

Machine Learning · Computer Science 2023-07-24 Okezzi F. Ukorigho , Opeoluwa Owoyele

We present a collective coordinate approach to describe coupled phase oscillators. We apply the method to study synchronisation in a Kuramoto model. In our approach an N-dimensional Kuramoto model is reduced to an n-dimensional ordinary…

Pattern Formation and Solitons · Physics 2015-05-21 Georg A. Gottwald

The emergence of macroscopic variables can be effected through {\it coarse graining}. Despite practical and fundamental benefits conveyed by this partitioning of state space, the apparently subjective nature of the selection of coarse…

Statistical Mechanics · Physics 2016-08-31 L. S. Schulman , B. Gaveau

Unsupervised learning with functional data is an emerging paradigm of machine learning research with applications to computer vision, climate modeling and physical systems. A natural way of modeling functional data is by learning operators…

Machine Learning · Computer Science 2023-02-22 Jacob H. Seidman , Georgios Kissas , George J. Pappas , Paris Perdikaris

Dynamics of complex systems are often driven by interactions that extend beyond pairwise links, underscoring the need to establish a correspondence between interpretable system parameters and emergent phenomena in hypergraph-based networks.…

Adaptation and Self-Organizing Systems · Physics 2026-04-10 Dhrubajyoti Biswas , Arpan Banerjee

Synchronization of non-identical oscillators coupled through complex networks is an important example of collective behavior. It is interesting to ask how the structural organization of network interactions influences this process. Several…

Adaptation and Self-Organizing Systems · Physics 2017-09-13 Lia Papadopoulos , Jason Kim , Jurgen Kurths , Danielle S. Bassett

We propose a machine learning framework to accelerate numerical computations of time-dependent ODEs and PDEs. Our method is based on recasting (generalizations of) existing numerical methods as artificial neural networks, with a set of…

Numerical Analysis · Mathematics 2019-03-08 Siddhartha Mishra

Synchronization in networks of coupled oscillators is classically studied via the Kuramoto model, whose intrinsic nonlinearity limits analytical tractability and complicates control design. Complex-valued extensions circumvent this by…

Systems and Control · Electrical Eng. & Systems 2026-04-09 Lorenzo Giordano , Josep M. Olm , Mario di Bernardo

Small inter-class and large intra-class variations are the main challenges in fine-grained visual classification. Objects from different classes share visually similar structures and objects in the same class can have different poses and…

Computer Vision and Pattern Recognition · Computer Science 2019-09-09 Amir Erfan Eshratifar , David Eigen , Michael Gormish , Massoud Pedram

Orientation-rich images, such as fingerprints and textures, often exhibit coherent angular directional patterns that are challenging to model using standard generative approaches based on isotropic Euclidean diffusion. Motivated by the role…

Machine Learning · Computer Science 2026-03-11 Yue Song , T. Anderson Keller , Sevan Brodjian , Takeru Miyato , Yisong Yue , Pietro Perona , Max Welling

The purpose of this article is to provide a perspective -- admittedly, a rather subjective one -- of recent developments at the interface of machine learning/data-driven methods and nonlinear wave studies. We review some recent pillars of…

Pattern Formation and Solitons · Physics 2026-04-15 Jimmie Adriazola , Panayotis G. Kevrekidis , Vassilis Koukouloyannis , Wei Zhu

Higher-order networks with multiway interactions can exhibit collective dynamical phenomena that are absent in traditional pairwise network models. However, analyzing such dynamics becomes computationally prohibitive as their state space…

Quantum Physics · Physics 2026-04-23 Caesnan M. G. Leditto , Angus Southwell , Muhammad Usman , Kavan Modi

Data-driven discovery of "hidden physics" -- i.e., machine learning of differential equation models underlying observed data -- has recently been approached by embedding the discovery problem into a Gaussian Process regression of spatial…

Machine Learning · Computer Science 2019-08-05 Mamikon Gulian , Maziar Raissi , Paris Perdikaris , George Karniadakis
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