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Degree-based topological indices and entropies of diamond crystals [PDF]

open access: yesScience Progress
High hardness, low friction coefficient and chemical resistance are only a few of the exceptional mechanical qualities of diamond. Diamonds can be artificially created to have different levels of conductivity, or they can be single, micro or ...
Abdul Rauf Khan   +6 more
doaj   +6 more sources

Computing degree based topological indices of algebraic hypergraphs [PDF]

open access: yesHeliyon
Topological indices are numerical parameters that indicate the topology of graphs or hypergraphs. A hypergraph H=(V(H),E(H)) consists of a vertex set V(H) and an edge set E(H), where each edge e∈E(H) is a subset of V(H) with at least two elements.
Amal S. Alali   +4 more
doaj   +5 more sources

A QSPR analysis of physical properties of antituberculosis drugs using neighbourhood degree-based topological indices and support vector regression. [PDF]

open access: yesHeliyon
Topological indices are molecular descriptors used in QSPR modelling to predict the physicochemical properties of molecules. Topological indices are used in numerous applications in drug design.
Abubakar MS   +3 more
europepmc   +4 more sources

Curvilinear regression analysis of benzenoid hydrocarbons and computation of some reduced reverse degree based topological indices for hyaluronic acid-paclitaxel conjugates [PDF]

open access: yesScientific Reports, 2023
Graph theoretical molecular descriptors alias topological indices are a convenient means for expressing in numerical form the chemical structure encoded in a molecular graph.
Vignesh Ravi, Kalyani Desikan
doaj   +3 more sources

Degree-Based Topological Indices of Boron B12 [PDF]

open access: yesJournal of Chemistry, 2021
Topological index sometimes called molecular descriptor is a numerical value which associates a chemical composition for correlating chemical structure with numerous physical properties, chemical reactivity, or biological activity.
Nouman Saeed   +4 more
doaj   +2 more sources

On Degree-Based Topological Indices of Carbon Nanocones. [PDF]

open access: yesACS Omega, 2022
Topological descriptors are numerical numbers that are assigned to molecular structures and can predict certain physicochemical properties. Because of their importance in nanotechnology and as developing materials with practical uses, the topological properties of nanocones have received a lot of attention.
Sharma K, Bhat VK, Sharma SK.
europepmc   +3 more sources

Degree-based topological indices of boron nanotubes

open access: yesAIP Advances, 2023
In the past two decades, boron nanotubes have received significant attention from researchers and scientists due to their wide-ranging applications in electronics, nanodevices, optical engineering, nanobiotechnology, and cosmetics.
Sohan Lal, Shriya Negi, Vijay Kumar Bhat
doaj   +2 more sources

Computation of domination degree-based topological indices using python and QSPR analysis of physicochemical and ADMET properties for heart disease drugs. [PDF]

open access: yesFront Chem
Heart disease is a leading cause of death worldwide, highlighting the need for effective treatments for hypertension, arrhythmias, and high cholesterol.
Kuriachan G, Parthiban A.
europepmc   +2 more sources

Reduced reverse degree-based topological indices of graphyne and graphdiyne nanoribbons with applications in chemical analysis. [PDF]

open access: yesSci Rep
Graphyne and Graphdiyne Nanoribbons reveal significant prospective with diverse applications. In electronics, they propose unique electronic properties for high-performance nanoscale devices, while in catalysis, their excellent surface area and ...
Zaman S, Hakami KH, Rasheed S, Agama FT.
europepmc   +2 more sources

Computing Some Degree-Based Topological Indices of Honeycomb Networks [PDF]

open access: yesComplexity, 2022
A topological index is a numeric quantity related with the chemical composition claiming to correlate the chemical structure with different chemical properties. Topological indices serve to predict physicochemical properties of chemical substance.
Lili Gu   +4 more
doaj   +2 more sources

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