期刊
JOURNAL OF APPLIED MATHEMATICS AND COMPUTING
卷 68, 期 6, 页码 4507-4536出版社
SPRINGER HEIDELBERG
DOI: 10.1007/s12190-021-01600-2
关键词
Sugammadex; Topological indices; Zagreb index; Wiener polarity; Atom bond connectivity index; Geometric-Arithmetic index; Variable Zagreb; Eccentric connectivity index; Randic index
This article discusses the importance and application of topological indices in drug development research, as well as the study of topological descriptors for Sugammadex.
The activity of a molecule is related to its structure, and thus any mathematical or topological technique that can specify the underlying topological building of a molecule is important and useful. Recently, mathematical techniques have been used to characterize their structures, topologically, to find statistical correlations between their structures and drug activity. Among them, topological indices and their developments have absorbed significant consideration from both mathematical and medicinal chemists. Sugammadex is a relaxant binding agent that can be sought after the management of the aminosterioid non-depolarizing neuromuscular-blocking factors. The role of topological indices in drug development research is updated. A series of definitions in the fields of topological indices and drug discovery technologies are introduced. The aim of this paper is to investigate several well-known topological descriptors for Sugammadex.
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