English
Related papers

Related papers: Topological Data Analysis of Ion Migration Mechani…

200 papers

In this article, we introduce a Topological Data Analysis (TDA) pipeline for neural spike train data. Understanding how the brain transforms sensory information into perception and behavior requires analyzing coordinated neural population…

Methodology · Statistics 2025-12-10 Cagatay Ayhan , Audrey N. Nash , Roberto Vincis , Martin Bauer , Richard Bertram , Tom Needham

Intramolecular ion-pair interactions yield shape and functionality to many molecules. With proper orientation, these interactions overcome steric factors and are responsible for the compact structures of several peptides. In this study, we…

Chemical Physics · Physics 2023-09-19 Sabyasachi Chakraborty , Kalyaneswar Mandal , Raghunathan Ramakrishnan

The study of phase transitions using data-driven approaches is challenging, especially when little prior knowledge of the system is available. Topological data analysis is an emerging framework for characterizing the shape of data and has…

Statistical Mechanics · Physics 2021-05-26 Quoc Hoan Tran , Mark Chen , Yoshihiko Hasegawa

Three novel applications of computational topology in the field of fusion science are developed. A procedure for the automatic classification of the orbits of magnetic field lines into topologically distinct classes using Vietoris-Rips…

Plasma Physics · Physics 2024-10-25 Nicholas Bohlsen

The paper studies the topological changes from before and after cointegration, for the natural frequencies of the Z24 Bridge. The second natural frequency is known to be nonlinear in temperature, and this will serve as the main focal point…

Algebraic Topology · Mathematics 2022-12-23 Tristan Gowdridge , Elizabeth Cross , Nikolaos Dervilis , Keith Worden

Large amplitude gust encounters exhibit a range of separated flow phenomena, making them difficult to characterize using the traditional tools of aerodynamics. In this work, we propose a dynamical systems approach to gust encounters,…

Fluid Dynamics · Physics 2024-11-20 Luke Smith , Kai Fukami , Girguis Sedky , Anya Jones , Kunihiko Taira

Identifying molecular signatures from complex disease patients with underlying symptomatic similarities is a significant challenge in the analysis of high dimensional multi-omics data. Topological data analysis (TDA) provides a way of…

Genomics · Quantitative Biology 2024-04-23 Davide Gurnari , Aldo Guzmán-Sáenz , Filippo Utro , Aritra Bose , Saugata Basu , Laxmi Parida

Ab initio molecular dynamics simulations are used to investigate the structure and electronic properties of the liquid Ag-Se system at three compositions. The realism of the simulations is demonstrated by comparison with diffraction data…

mtrl-th · Physics 2009-10-28 F. Kirchhoff , J. M. Holender , M. J. Gillan

We study transport properties of the helical edge states of two-dimensional integer and fractional topological insulators via double constrictions. Such constrictions couple the upper and lower edges of the sample, and can be made and tuned…

Strongly Correlated Electrons · Physics 2013-09-25 Chia-Wei Huang , Sam T. Carr , Dmitri Gutman , Efrat Shimshoni , Alexander D. Mirlin

We present a topological framework for analysing neural time series that integrates Transfer Entropy (TE) with directed Persistent Homology (PH) to characterize information flow in spiking neural systems. TE quantifies directional influence…

Neurons and Cognition · Quantitative Biology 2025-08-27 Dylan Peek , Siddharth Pritam , Matthew P. Skerritt , Stephan Chalup

Collective epithelial migration leverages on topological rearrangements of the intercellular junctions, which allow cells to intercalate without loosing confluency. In silico studies have provided a clear indication that this process could…

Soft Condensed Matter · Physics 2025-02-14 Leonardo Puggioni , Dimitrios Krommydas , Luca Giomi

A method for generating angular forces around $\sigma$-bonded transition metal ions is generalized to treat $\pi$-bonded configurations. The theoretical approach is based on an analysis of a ligand-field Hamiltonian based on the moments of…

Soft Condensed Matter · Physics 2009-10-31 A. E. Carlsson , S. Zapata

We study the electrical conductance $G$ and the thermopower $S$ of single-molecule junctions, and reveal signatures of different transport mechanisms: off-resonant tunneling, on-resonant coherent (ballistic) motion, and multi-step hopping.…

Mesoscale and Nanoscale Physics · Physics 2017-04-12 Roman Korol , Michael Kilgour , Dvira Segal

Graph motif, defined as the microstructure that appears repeatedly in a large graph, reveals important topological characteristics of the large graph and has gained increasing attention in power system analysis regarding reliability,…

Systems and Control · Electrical Eng. & Systems 2024-12-10 Yiyan Li , Zhenghao Zhou , Jian Ping , Xiaoyuan Xu , Zheng Yan , Jianzhong Wu

Recent studies have identified plasma as a topological material. Yet, these researches often depict plasma as a fluid governed by electromagnetic fields, i.e., a classical wave system. Indeed, plasma transport can be characterized by a…

Plasma Physics · Physics 2023-11-01 Zhoufei Liu , Jiping Huang

We develop a topology data analysis-based method to detect early signs for critical transitions in financial data. From the time-series of multiple stock prices, we build time-dependent correlation networks, which exhibit topological…

Mathematical Finance · Quantitative Finance 2017-01-24 Marian Gidea

In this paper, we propose a novel framework for dynamical analysis of human actions from 3D motion capture data using topological data analysis. We model human actions using the topological features of the attractor of the dynamical system.…

Computational Geometry · Computer Science 2016-03-18 Vinay Venkataraman , Karthikeyan Natesan Ramamurthy , Pavan Turaga

Topological defects are ubiquitous from solid state physics to cosmology, where they drive phase transitions by proliferating as domain walls, monopoles or vortices. As quantum excitations, they often display fractional charge and anyonic…

Mesoscale and Nanoscale Physics · Physics 2012-03-27 R. Koushik , Matthias Baenninger , Vijay Narayan , Subroto Mukerjee , Michael Pepper , Ian Farrer , David A. Ritchie , Arindam Ghosh

An important aspect in categorizing topological phases is whether the system is spinless or spinful, given that these classes exhibit distinct symmetry algebras, leading to disparate topological classifications. By utilizing the projective…

Quantum Gases · Physics 2026-01-21 Xiaofan Zhou , Suotang Jia , Jian-Song Pan

This paper develops a tractable analytical channel model for first-hitting-time molecular communication (MC) systems under time-varying drift. While existing studies of nonstationary transport rely primarily on numerical solutions of…

Information Theory · Computer Science 2026-03-30 Yen-Chi Lee