Quantitative structure-property relationships (QSPR) of valency based topological indices with Covid-19 drugs and application

Quantitative structure-property relationships (QSPR) of valency based topological indices with Covid-19 drugs and application

The purpose of this analysis is to establish a quantitative structure–property relationship (QSPR) between eV and ve-degree based topological descriptors and measured physicochemical parameters of phytochemicals screened against SARS-CoV-2 3CLpro. A computer-based algorithm is developed to compute t...

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Bibliographic Details
Main Authors: Jian-Feng Zhong, Abdul Rauf, Muhammad Naeem, Jafer Rahman, Adnan Aslam
Format: Article
Language:English
Published: Elsevier 2021-07-01
Series:Arabian Journal of Chemistry
Subjects:
05C09
05C92
92E10
Online Access:http://www.sciencedirect.com/science/article/pii/S1878535221002550

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