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A numerical parameter, known as a topological index, is employed to represent the molecular structure of a compound by considering its graph-theoretical properties. In the study of quantitative structure-activity relationships (QSAR) and…

介观与纳米尺度物理 · 物理学 2024-06-03 H. M. Nagesh

A numerical parameter, known as a topological index, is employed to represent the molecular structure of a compound by considering its graph-theoretical properties. In the study of quantitative structure-activity relationships (QSAR) and…

材料科学 · 物理学 2024-05-31 H. M. Nagesh , Muhammad Kamran Siddiqui

Carbon nanotube Y-junctions are of great interest to the next generation of innovative multi-terminal nanodevices. Topological indices are graph-theoretically based parameters that describe various structural properties of a chemical…

介观与纳米尺度物理 · 物理学 2023-01-06 Sohan Lal , Vijay Kumar Bhat , Sahil Sharma

Topological index is a numerical value associated with chemical constitution for correlation of chemical structure with various physical properties, chemical reactivity or biological activity. In this work, some new indices based on…

离散数学 · 计算机科学 2019-06-18 Sourav Mondal , Nilanjan De , Anita Pal

In chemical graph theory, topological indices are widely used as numerical descriptors for establishing quantitative structure-property relationships (QSPR) and quantitative structure-activity relationships (QSAR). These indices…

化学物理 · 物理学 2025-11-05 U. Vijaya Chandra Kumar , H. M. Nagesh , Narahari N

Topological entropy is a measure of complex dynamics. In this regard, multimodal maps play an important role when it comes to study low-dimensional chaotic dynamics or explain some features of higher dimensional complex dynamics with…

动力系统 · 数学 2013-10-31 Jose M. Amigo , Angel Gimenez

Topological indices are graph invariants numeric quantities, which are utilized by researchers to analyze a variety of physiochemical aspects of molecules. The goal of developing topological indices is to give each chemical structure a…

组合数学 · 数学 2022-12-09 Sohan Lal , Karnika Sharma , Vijay Kumar Bhat

We analyze the nature of the structural order established in liquid TIP4P water in the framework provided by the multi-particle correlation expansion of the statistical entropy. Different regimes are mapped onto the phase diagram of the…

材料科学 · 物理学 2011-10-25 Rubens Esposito , Franz Saija , A. Marco Saitta , Paolo V. Giaquinta

In this study, we devise a model that introduces two hierarchies into information entropy. The two hierarchies are the size of the region for which entropy is calculated and the size of the component that determines whether the structures…

计算机视觉与模式识别 · 计算机科学 2021-04-21 Nao Uehara , Teruaki Hayashi , Yukio Ohsawa

Entropy metrics (for example, permutation entropy) are nonlinear measures of irregularity in time series (one-dimensional data). Some of these entropy metrics can be generalised to data on periodic structures such as a grid or lattice…

组合数学 · 数学 2021-10-22 John Stewart Fabila-Carrasco , Chao Tan , Javier Escudero

Measuring similarity between complex objects is a fundamental task in many scientific fields. When objects are represented as graphs, graph similarity/distance measures offer a powerful framework for quantifying structural resemblance.…

The number of dimer-monomers (matchings) of a graph $G$ is an important graph parameter in statistical physics. Following recent research, we study the asymptotic behavior of the number of dimer-monomers $m(G)$ on the Towers of Hanoi graphs…

数学物理 · 物理学 2015-09-30 Hanlin Chen , Renfang Wu , Guihua Huang , Hanyuan Deng

A characterization of topological order in terms of bi-partite entanglement was proposed recently [A. Kitaev and J. Preskill, Phys. Rev. Lett. 96, 110404 (2006); M. Levin and X.-G. Wen, ibid, 110405]. It was argued that in a topological…

强关联电子 · 物理学 2011-11-09 Shunsuke Furukawa , Gregoire Misguich

Entanglement measures find frequent application in the study of topologically ordered systems, where the presence of topological order is reflected in an additional contribution to the entanglement of the system. Obtaining this topological…

强关联电子 · 物理学 2014-05-07 Claudio Castelnovo

Topological indices are scientific details of graphs which represents its topology and of the most part graph invariant. In QSAR/QSPR, physico-chemical characteristics and topological indices, for example, atom bond connectivity (ABC) and…

组合数学 · 数学 2019-10-24 Haidar Ali , Farzana Kousar

Calculation of topological order parameters, such as the topological entropy and topological mutual information, are used to determine whether states possess topological order. Their calculation is expected to give reliable results when the…

强关联电子 · 物理学 2012-05-16 James R. Wootton

There are various topological indices for example distance based topological indices and degree based topological indices etc. In QSAR/QSPR study, physiochemical properties and topological indices for example atom bond connectivity index,…

离散数学 · 计算机科学 2018-04-26 Raghisa Khalid , Nazeran Idrees

We study the applicability of a set of texture descriptors introduced in recent work by the author to texture-based segmentation of images. The texture descriptors under investigation result from applying graph indices from quantitative…

计算机视觉与模式识别 · 计算机科学 2017-09-22 Martin Welk

We develop information-theoretic measures of spatial structure and pattern in more than one dimension. As is well known, the entropy density of a two-dimensional configuration can be efficiently and accurately estimated via a converging…

统计力学 · 物理学 2009-11-07 David P. Feldman , James P. Crutchfield

The entropy of a graph is an information-theoretic quantity which expresses the complexity of a graph \cite{DM1,M}. After Shannon introduced the definition of entropy to information and communication, many generalizations of the entropy…

组合数学 · 数学 2014-11-26 Xueliang Li , Zhongmei Qin , Meiqin Wei , Ivan Gutman , Matthias Dehmer
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