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Coarse graining (CG) is an important task for efficient modeling and simulation of complex multi-scale systems, such as the conformational dynamics of biomolecules. This work presents a projection-based coarse-graining formalism for general…

Computational Physics · Physics 2026-05-28 Vahid Nateghi , Lara Neureither , Selma Moqvist , Carsten Hartmann , Simon Olsson , Feliks Nüske

Graph topology inference of network processes with co-evolving and interacting time-series is crucial for network studies. Vector autoregressive models (VAR) are popular approaches for topology inference of directed graphs; however, in…

Machine Learning · Computer Science 2020-11-18 M. Ali Vosoughi , Axel Wismuller

Using an information theoretic point of view, we investigate how a dynamics acting on a network can be coarse grained through the use of graph partitions. Specifically, we are interested in how aggregating the state space of a Markov…

Physics and Society · Physics 2017-11-07 Mauro Faccin , Michael T. Schaub , Jean-Charles Delvenne

We propose an adaptive graph coarsening method to jointly learn graph neural network (GNN) parameters and merge nodes via K-means clustering during training. As real-world graphs grow larger, processing them directly becomes increasingly…

Machine Learning · Computer Science 2025-10-01 Rostyslav Olshevskyi , Madeline Navarro , Santiago Segarra

We consider a Graph Neural Network (GNN) non-Markovian modeling framework to identify coarse-grained dynamical systems on graphs. Our main idea is to systematically determine the GNN architecture by inspecting how the leading term of the…

Numerical Analysis · Mathematics 2025-04-08 Yin Yu , John Harlim , Daning Huang , Yan Li

We propose and illustrate an approach to coarse-graining the dynamics of evolving networks (networks whose connectivity changes dynamically). The approach is based on the equation-free framework: short bursts of detailed network evolution…

Social and Information Networks · Computer Science 2012-02-28 Katherine A. Bold , Karthikeyan Rajendran , Balázs Ráth , Ioannis G. Kevrekidis

Coarse-graining has become an area of tremendous importance within many different research fields. For molecular simulation, coarse-graining bears the promise of finding simplified models such that long-time simulations of large-scale…

Chemical Physics · Physics 2019-09-04 Feliks Nüske , Lorenzo Boninsegna , Cecilia Clementi

A communication network can be modeled as a directed connected graph with edge weights that characterize performance metrics such as loss and delay. Network tomography aims to infer these edge weights from their pathwise versions measured…

Optimization and Control · Mathematics 2019-08-12 Mahmood Ettehad , Nick Duffield , Gregory Berkolaiko

Network analysis is rapidly becoming a standard tool for studying functional magnetic resonance imaging (fMRI) data. In this framework, different brain areas are mapped to the nodes of a network, whose links depict functional dependencies…

Neurons and Cognition · Quantitative Biology 2017-05-30 Rainer Kujala , Enrico Glerean , Raj Kumar Pan , Iiro P. Jääskeläinen , Mikko Sams , Jari Saramäki

We propose a data-driven, coarse-graining formulation in the context of equilibrium statistical mechanics. In contrast to existing techniques which are based on a fine-to-coarse map, we adopt the opposite strategy by prescribing a…

Machine Learning · Statistics 2017-02-01 Markus Schöberl , Nicholas Zabaras , Phaedon-Stelios Koutsourelakis

Many real-world networks display a natural bipartite structure, while analyzing or visualizing large bipartite networks is one of the most challenges. As a result, it is necessary to reduce the complexity of large bipartite systems and…

Physics and Society · Physics 2013-01-09 Yang Wang , An Zeng , Zengru Di , Ying Fan

Very recently, a kind of spatial network constructed with power-law distance distribution and total energy constriction is proposed. Moreover, it has been pointed out that such spatial networks have the optimal exponents $\delta$ in the…

Physics and Society · Physics 2015-05-19 An Zeng , Dong Zhou , Yanqing Hu , Ying Fan , Zengru Di

Coarse-graining is a powerful tool for extending the reach of dynamic models of proteins and other biological macromolecules. Topological coarse-graining, in which biomolecules or sets thereof are represented via graph structures, is a…

Biomolecules · Quantitative Biology 2021-09-15 Vy Duong , Elizabeth Diessner , Gianmarc Grazioli , Rachel W. Martin , Carter T. Butts

We perform the renormalization-group-like numerical analysis of geographically embedded complex networks on the two-dimensional square lattice. At each step of coarsegraining procedure, the four vertices on each $2 \times 2$ square box are…

Disordered Systems and Neural Networks · Physics 2007-05-23 Beom Jun Kim

We propose new mathematical optimization models for generating sparse dynamical graphs, or networks, that can achieve synchronization. The synchronization phenomenon is studied using the Kuramoto model, defined in terms of the adjacency…

Optimization and Control · Mathematics 2020-06-23 Regina S. Burachik , Alexander C. Kalloniatis , C. Yalçın Kaya

Many real-world systems of coupled agents exhibit directed interactions, meaning that the influence of an agent on another is not reciprocal. Furthermore, interactions usually do not have identical amplitude and/or sign. To describe…

Adaptation and Self-Organizing Systems · Physics 2019-08-13 Robin Delabays , Philippe Jacquod , Florian Dörfler

Finding accurate reduced descriptions for large, complex, dynamically evolving networks is a crucial enabler to their simulation, analysis, and, ultimately, design. Here we propose and illustrate a systematic and powerful approach to…

Chaotic Dynamics · Physics 2017-05-02 Tom Bertalan , Yan Wu , Carlo Laing , C. William Gear , Ioannis G. Kevrekidis

Tensor network techniques have proved to be powerful tools that can be employed to explore the large scale dynamics of lattice systems. Nonetheless, the redundancy of degrees of freedom in lattice gauge theories (and related models) poses a…

General Relativity and Quantum Cosmology · Physics 2016-05-12 Bianca Dittrich , Sebastian Mizera , Sebastian Steinhaus

We propose, and illustrate via a neural network example, two different approaches to coarse-graining large heterogeneous networks. Both approaches are inspired from, and use tools developed in, methods for uncertainty quantification in…

Adaptation and Self-Organizing Systems · Physics 2016-11-03 Minseok Choi , Tom Bertalan , Carlo R. Laing , Ioannis G. Kevrekidis

Most real systems are growing. In order to model the evolution of real systems, many growing network models have been proposed to reproduce some specific topology properties. As the structure strongly influences the network function,…

Physics and Society · Physics 2015-05-28 Y. Wang , A. Zeng , Z. Di , Y. Fan