Solvent Accessible Surface Area | List of Frontiers open access articles

Original Research

Published on 25 Mar 2022

Anti-Fungal Drug Anidulafungin Inhibits SARS-CoV-2 Spike-Induced Syncytia Formation by Targeting ACE2-Spike Protein Interaction

in Computational Genomics

Shahzaib Ahamad
Hashim Ali
Ilaria Secco
Mauro Giacca
Dinesh Gupta

Frontiers in Genetics

doi 10.3389/fgene.2022.866474

5,413 views
19 citations

Original Research

Published on 24 Nov 2022

Molecular docking and molecular dynamics study Lianhua Qingwen granules (LHQW) treats COVID-19 by inhibiting inflammatory response and regulating cell survival

in Clinical and Diagnostic Microbiology and Immunology

Jun-Feng Cao
Yunli Gong
Mei Wu
Li Xiong
Shengyan Chen
Haonan Huang
Xinge Zhou
Ying-chun Peng
Xue-fang Shen
Jinyu Qu

Frontiers in Cellular and Infection Microbiology

doi 10.3389/fcimb.2022.1044770

6,214 views
15 citations

Original Research

Published on 07 Mar 2022

Molecular Polar Surface Area, Total Solvent Accessible Surface Area (SASA), Heat of Formation, and Gamma-Ray Attenuation Properties of Some Flavonoids

in Atomic and Molecular Physics

Huseyin Ozan Tekin
Ghada ALMisned
Shams A. M. Issa
Emel Serdaroglu Kasikci
Mahreen Arooj
Antoaneta Ene
M. S. Al-Buriahi
Muhsin Konuk
Hesham M. H. Zakaly

Frontiers in Physics

doi 10.3389/fphy.2022.838725

7,471 views
21 citations

Original Research

Published on 07 Jul 2021

Remdesivir Strongly Binds to RNA-Dependent RNA Polymerase, Membrane Protein, and Main Protease of SARS-CoV-2: Indication From Molecular Modeling and Simulations

in Experimental Pharmacology and Drug Discovery

Faez Iqbal Khan
Tongzhou Kang
Haider Ali
Dakun Lai

Frontiers in Pharmacology

doi 10.3389/fphar.2021.710778

11,043 views
53 citations

Original Research

Published on 25 Jul 2022

Effect of Date Palm (Phoenix dactylifera) Phytochemicals on Aβ1−40 Amyloid Formation: An in-silico Analysis

in Neurodegeneration

Qamar Zia
Md Tabish Rehman
Md Amiruddin Hashmi
Sahabjada Siddiqui
Abdulaziz Bin Dukhyil
Mohammad Z. Ahmed
Azfar Jamal
Saeed Banawas
Sami G. Almalki
Mohammad Owais

Frontiers in Neuroscience

doi 10.3389/fnins.2022.915122

6,527 views
15 citations

Original Research

Published on 29 May 2025

In silico analysis of Triphala-derived polyphenols as inhibitors of TIR–TIR homodimerization in the inflammatory pathway

in Drug Discovery in Bioinformatics

Durgadevi Rajendran
Nalini Easwaran

Frontiers in Bioinformatics

doi 10.3389/fbinf.2025.1565700

24,255 views

Articles

Anti-Fungal Drug Anidulafungin Inhibits SARS-CoV-2 Spike-Induced Syncytia Formation by Targeting ACE2-Spike Protein Interaction

Molecular docking and molecular dynamics study Lianhua Qingwen granules (LHQW) treats COVID-19 by inhibiting inflammatory response and regulating cell survival

Molecular Polar Surface Area, Total Solvent Accessible Surface Area (SASA), Heat of Formation, and Gamma-Ray Attenuation Properties of Some Flavonoids

Remdesivir Strongly Binds to RNA-Dependent RNA Polymerase, Membrane Protein, and Main Protease of SARS-CoV-2: Indication From Molecular Modeling and Simulations

Effect of Date Palm (Phoenix dactylifera) Phytochemicals on Aβ1−40 Amyloid Formation: An in-silico Analysis

In silico analysis of Triphala-derived polyphenols as inhibitors of TIR–TIR homodimerization in the inflammatory pathway