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5 articles related to "Dock Score"

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Articles

Original Research

Published on 10 May 2021

Pharmacophore Modelling-Based Drug Repurposing Approaches for SARS-CoV-2 Therapeutics

in Theoretical and Computational Chemistry

Shailima Rampogu
Keun Woo Lee

Frontiers in Chemistry

doi 10.3389/fchem.2021.636362

7,053 views
31 citations

Original Research

Published on 24 Mar 2023

Targeting dormant phenotype acquired mycobacteria using natural products by exploring its important targets: In vitro and in silico studies

in Bacteria and Host

Shweta Sharma
Rupesh Chikhale
Nivedita Shinde
A. M. Khan
Vivek Kumar Gupta

Frontiers in Cellular and Infection Microbiology

doi 10.3389/fcimb.2023.1111997

4,655 views
13 citations

Original Research

Published on 24 Nov 2020

Novel Leu-Val Based Dipeptide as Antimicrobial and Antimalarial Agents: Synthesis and Molecular Docking

in Medicinal and Pharmaceutical Chemistry

James A. Ezugwu
Uchechukwu C. Okoro
Mercy A. Ezeokonkwo
China R. Bhimapaka
Sunday N. Okafor
David I. Ugwu
Ogechi C. Ekoh
Solomon I. Attah

Frontiers in Chemistry

doi 10.3389/fchem.2020.583926

5,786 views
16 citations

Original Research

Published on 23 Sep 2022

Study of tyramine-binding mechanism and insecticidal activity of oil extracted from Eucalyptus against Sitophilus oryzae

in Theoretical and Computational Chemistry

Farshid Zargari
Zahra Nikfarjam
Ebrahim Nakhaei
Masoumeh Ghorbanipour
Alireza Nowroozi
Azam Amiri

Frontiers in Chemistry

doi 10.3389/fchem.2022.964700

3,680 views
10 citations

Original Research

Published on 13 Oct 2023

Analysis of some flavonoids for inhibitory mechanism against cancer target phosphatidylinositol 3-kinase (PI3K) using computational tool

in Experimental Pharmacology and Drug Discovery

Mohd Suhail
Wejdan M. AlZahrani
Shazi Shakil
Mohammad Tarique
Shams Tabrez
Torki A. Zughaibi
Mohd Rehan

Frontiers in Pharmacology

doi 10.3389/fphar.2023.1236173

4,939 views
29 citations