scholarly journals Degree-Based Topological Indices of Polysaccharides: Amylose and Blue Starch-Iodine Complex

2021 ◽  
Vol 2021 ◽  
pp. 1-10
Author(s):  
Anam Rani ◽  
Usman Ali

Starch is a polymer of glucose where alpha-linkages are associated with glucopyranose units. It comprises a mixture of amylose and amylopectin. Furthermore, amylose is a linear chain of hundreds of glucose molecules. Starches are not allowed to be dissolved in water. They can be digested by breaking down alpha bonds (glycosidic bonds). Its cyclic degradation products, called cyclodextrins, are the best role models for amylose. They can be considered simple turns of the amylose propeller that has imploded into a circular path. Both humans and animals have amylases, which allow them to digest starches. The important sources of starch include potatoes, rice, wheat, and maize for human consumption. The production of starches is how plants store glucose. The blue colour of starch produced by an iodine solution or iodine reaction is used for its identification. Polysaccharides with a reduced degree of polymerization, known as dextrins, are produced in the starch’s partial acid hydrolysis. Complete hydrolysis leads to glucose. In this article, we compute the topological properties: Zagreb index M 1 Γ and M 2 Γ , Randić index R α Γ for α = − 1 / 2 , − 1 , 1 / 2 , 1 , atom-bond connectivity index ABC Γ , geometric-arithmetic index GA Γ , fourth atom-bond connectivity index ABC 4 Γ , fifth geometric-arithmetic index GA 5 Γ , and degree-based topological indices of a graph Γ representing polysaccharides, namely, amylose and blue starch-iodine complex. In the end, we compare these indices and depict their graphic behavior.

2021 ◽  
Vol 2021 ◽  
pp. 1-12
Author(s):  
Muhammad Asad Ali ◽  
Muhammad Shoaib Sardar ◽  
Imran Siddique ◽  
Dalal Alrowaili

A measurement of the molecular topology of graphs is known as a topological index, and several physical and chemical properties such as heat formation, boiling point, vaporization, enthalpy, and entropy are used to characterize them. Graph theory is useful in evaluating the relationship between various topological indices of some graphs derived by applying certain graph operations. Graph operations play an important role in many applications of graph theory because many big graphs can be obtained from small graphs. Here, we discuss two graph operations, i.e., double graph and strong double graph. In this article, we will compute the topological indices such as geometric arithmetic index GA , atom bond connectivity index ABC , forgotten index F , inverse sum indeg index ISI , general inverse sum indeg index ISI α , β , first multiplicative-Zagreb index PM 1   and second multiplicative-Zagreb index PM 2 , fifth geometric arithmetic index GA 5 , fourth atom bond connectivity index ABC 4 of double graph, and strong double graph of Dutch Windmill graph D 3 p .


2018 ◽  
Vol 7 (2) ◽  
pp. 123-129 ◽  
Author(s):  
Adnan Aslam ◽  
Muhammad Kamran Jamil ◽  
Wei Gao ◽  
Waqas Nazeer

AbstractA numerical number associated to the molecular graphGthat describes its molecular topology is called topological index. In the study ofQSARandQSPR, topological indices such as atom-bond connectivity index, Randić connectivity index, geometric index, etc. help to predict many physico-chemical properties of the chemical compound under study. Dendrimers are macromolecules and have many applications in chemistry, especially in self-assembly procedures and host-guest reactions. The aim of this report is to compute degree-based topological indices, namely the fourth atom-bond connectivity index and fifth geometric arithmetic index of poly propyl ether imine, zinc porphyrin, and porphyrin dendrimers.


Author(s):  
K. Pattabiraman ◽  
A. Santhakumar

In this paper, we obtain the exact formulae for some topological indices such as the general sum-connectivity index, atom-bond connectivity index, geometric arithmetic index, inverse sum indeg index, symmetric division deg index and harmonic polynomial of titania TiO2 Nanotubes and Sudoku graphs.


2020 ◽  
Vol 2020 ◽  
pp. 1-7 ◽  
Author(s):  
Xuewu Zuo ◽  
Jia-Bao Liu ◽  
Hifza Iqbal ◽  
Kashif Ali ◽  
Syed Tahir Raza Rizvi

Topological indices like generalized Randić index, augmented Zagreb index, geometric arithmetic index, harmonic index, product connectivity index, general sum-connectivity index, and atom-bond connectivity index are employed to calculate the bioactivity of chemicals. In this paper, we define these indices for the line graph of k-subdivided linear [n] Tetracene, fullerene networks, tetracenic nanotori, and carbon nanotube networks.


2018 ◽  
Vol 7 (4.10) ◽  
pp. 403
Author(s):  
G. Mohanappriya ◽  
D. Vijiyalakshmi

Molecular descriptors (Topological indices) are the numerical invariants of a molecular graph which distinguish its topology. In this article, we compute edge version of topological indices such as Zagreb index, Atom bond connectivity index, Fourth atom bond connectivity index, Geometric Arithmetic index and Fifth Geometric Arithmetic index of tetrameric 1,3 adamantane. 


Processes ◽  
2019 ◽  
Vol 7 (7) ◽  
pp. 462
Author(s):  
Sumiya Nasir ◽  
Fozia Bashir Farooq ◽  
Nazeran Idrees ◽  
Muhammad Jawwad Saif ◽  
Fatima Saeed

A topological index of a graph is a single numeric quantity which relates the chemical structure with its underlying physical and chemical properties. Topological indices of a nanosheet can help us to understand the properties of the material better. This study deals with computation of degree-dependent topological indices like the Randic index, first Zagreb index, second Zagreb index, geometric arithmetic index, atom bond connectivity index, sum connectivity index and hyper Zagreb index of nanosheet covered by C3 and C6. Furthermore, M-polynomial of the nanosheet is also computed, which provides an alternate way to express the topological indices.


2021 ◽  
Vol 2021 ◽  
pp. 1-14
Author(s):  
Hong Yang ◽  
Muhammad Naeem

We have studied topological indices of the one the hardest crystal structures in a given chemical system, namely, M-carbon. These structures are based and obtained by the famous algorithm USPEX. The computations and applications of topological indices in the study of chemical structures is growing exponentially. Our aim in this article is to compare and compute some well-known topological indices based on degree and sum of degrees, namely, general Randić indices, Zagreb indices, atom bond connectivity index, geometric arithmetic index, new Zagreb indices, fourth atom bond connectivity index, fifth geometric arithmetic index, and Sanskruti index of the M-carbon M r , s , t . Moreover, we have also computed closed formulas for these indices.


2021 ◽  
Vol 2021 ◽  
pp. 1-10
Author(s):  
Xiujun Zhang ◽  
Muhammad Naeem ◽  
Abdul Qudair Baig ◽  
Manzoor Ahmad Zahid

Topological indices give immense information about a molecular structure or chemical structure. The hardness of materials for the indentation can be defined microscopically as the total resistance and effect of chemical bonds in the respective materials. The aim of this paper is to study the hardness of some superhard B C x crystals by means of topological indices, specifically Randić index and atom-bond connectivity index.


2021 ◽  
Vol 44 (1) ◽  
pp. 165-172
Author(s):  
Yongsheng Rao ◽  
Ammarah Kanwal ◽  
Riffat Abbas ◽  
Saima Noureen ◽  
Asfand Fahad ◽  
...  

Abstract In the modern era of the chemical science, the chemical graph theory has contributed significantly to exploring the properties of the chemical compounds. Currently, the computation of the topological indices is one of the most active directions of the research in the area of the chemical graph theory. The main feature of the study of the topological indices is its its ability of predicting the various physio-chemical properties. In this article, we compute several degree-based topological indices for the caboxy-terminated dendritic macromolecule. We compute Harmonic index, atom-bond connectivity index, geometric arithmetic index, sum connectivity index, inverse sum index, symmetric division degree, and Zagreb indices for caboxy-terminated dendritic macromolecule. The obtained results have potential to predict biochemical properties such as viscosity, entropy, and boiling point.


2016 ◽  
Vol 94 (8) ◽  
pp. 687-698 ◽  
Author(s):  
Shehnaz Akhter ◽  
Muhammad Imran

The degree-based topological indices correlate certain physicochemical properties such as boiling point, strain energy, and stability, etc., of certain chemical compounds. Among the major classes of topological indices are the distance-based topological indices, degree-based topological indices, and counting-related polynomials and corresponding indices of graphs. Among all of the degree-based indices, namely the first general Zagreb index, general Rndić connectivity index, general sum-connectivity index, atom–bond connectivity index (ABC), and geometric–arithmetic index (GA), are most important due to their chemical significance. In this paper, we compute the first general Zagreb index, general Randić connectivity index, general sum-connectivity index, ABC, GA, ABC4, and GA5 indices of hexagonal parallelogram P(m,n) nanotubes, triangular benzenoid Gn, and zigzag-edge coronoid fused with starphene ZCS(k,l,m) nanotubes by using the line graphs of the subdivision of these chemical graphs.


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