Abstract
In medical sciences, the molecular structure is discussed under the consideration of the topological index, and related biological, pharmaceutical, medical and chemical properties of various drugs are examined by computing topological indices. Many scientific experiments are ongoing for the medication of COVID-19 by using redeliver. In this paper, our objective is to calculate the degree-based temperature indices and their respective temperature entropies for the molecular graph of remdesivir R. In this study, we derived some degree-based temperature descriptors. Also, we computed temperature entropies of molecular structure by constructing the relation of degree-based temperature descriptors with the help of specific information functions. Moreover, we analyzed and provided a graphical comparison of the calculated outcomes. These computed results maybe lead to the discovery of more effective drugs and modified vaccines for the overcome with COVID-19.
| Original language | English |
|---|---|
| Article number | e26957 |
| Journal | International Journal of Quantum Chemistry |
| Volume | 122 |
| Issue number | 18 |
| DOIs | |
| State | Published - 15 Sep 2022 |
| Externally published | Yes |
Bibliographical note
Publisher Copyright:© 2022 Wiley Periodicals LLC.
Keywords
- Balaban temperature index
- COVID-19
- Zagreb temperature indices
- entropy
- forgotten temperature index
- general Randić temperature index
- remdesivir
- temperature indices
ASJC Scopus subject areas
- Atomic and Molecular Physics, and Optics
- Condensed Matter Physics
- Physical and Theoretical Chemistry
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