School of Computer Science, Chengdu University, Chengdu, China.
Department of Mathematics, Riphah International University Lahore, Lahore, Pakistan.
PLoS One. 2023 Jul 21;18(7):e0288931. doi: 10.1371/journal.pone.0288931. eCollection 2023.
Humanity has always benefited from an intercapillary study in the quantification of natural occurrences in mathematics and other pure scientific fields. Graph theory was extremely helpful to other studies, particularly in the applied sciences. Specifically, in chemistry, graph theory made a significant contribution. For this, a transformation is required to create a graph representing a chemical network or structure, where the vertices of the graph represent the atoms in the chemical compound and the edges represent the bonds between the atoms. The quantity of edges that are incident to a vertex determines its valency (or degree) in a graph. The degree of uncertainty in a system is measured by the entropy of a probability. This idea is heavily grounded in statistical reasoning. It is primarily utilized for graphs that correspond to chemical structures. The development of some novel edge-weighted based entropies that correspond to valency-based topological indices is made possible by this research. Then these compositions are applied to clay mineral tetrahedral sheets. Since they have been in use for so long, corresponding indices are thought to be the most effective methods for quantifying chemical graphs. This article develops multiple edge degree-based entropies that correlate to the indices and determines how to modify them in order to assess the significance of each type.
人类一直受益于在数学和其他纯科学领域对自然现象进行毛细血管研究的方法。图论对其他研究非常有帮助,特别是在应用科学中。具体来说,在化学中,图论做出了重大贡献。为此,需要进行转换,以创建一个表示化学网络或结构的图,其中图的顶点表示化学化合物中的原子,边表示原子之间的键。与顶点相连的边的数量决定了其在图中的价数(或度数)。系统的不确定性程度由概率的熵来衡量。这个想法主要基于统计推理。它主要用于对应于化学结构的图。通过这项研究,可以开发出一些与基于价拓扑指数的新型边加权熵相对应的方法。然后将这些组合应用于粘土矿物四面体片。由于它们已经使用了很长时间,因此相应的指数被认为是量化化学图的最有效方法。本文开发了多个与指数相关的基于边度数的熵,并确定如何修改它们以评估每种类型的重要性。