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21 results in Keywords: docking studies

Biological and Medicinal Chemistry

Working Paper

A NOVEL COMPUTATIONALLY DESIGNED DRUG TO TREAT THE COVID -19 PANDEMIC

Chikoo Cherian

Version 2 posted 06 April 2020

894

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Biological and Medicinal Chemistry

Working Paper

Molecular Docking study of Receptor Binding Domain of SARS-CoV-2 Spike Glycoprotein with Saikosaponin, a Triterpenoid Natural Product

Tamal Goswami, Bhaskar Bagchi

Version 1 posted 26 March 2020

1,639

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Biological and Medicinal Chemistry

Working Paper

Comprehensive Virtual Screening of the Antiviral Potentialities of Marine Polycyclic Guanidine Alkaloids against SARS-CoV-2 (Covid-19)

Amr El-Demerdash, Ahmed M. Metwaly, Tarek Mohamed Abd El-Aziz4, Ibrahim H. Eissa, James D. Stockand

Version 1 posted 07 December 2020

357

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Theoretical and Computational Chemistry

Working Paper

Structure-Based Screening of Potential Triterpenoids for Anti-Viral Activity Against SARS-CoV-2 and Related Coronaviruses

Vijaya sundar Jeyaraj, Thiagarayaselvam Aarthy

Version 1 posted 03 August 2020

586

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Theoretical and Computational Chemistry

Working Paper

Cheminformatics Modeling of Closantel Analogues for Treating River Blindness

Melaine A. Kuenemann, Phyo Phyo Zin, Sravya Kuchibhotla, Denis Fourches

Version 1 posted 17 January 2020

468

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Organic Chemistry

Working Paper

Plant-Derived Natural Polyphenols as Potential Antiviral Drugs Against SARS-CoV-2 via RNA‐dependent RNA Polymerase (RdRp) Inhibition: An In-Silico Analysis

Satyam Singh, Avinash Sonawane, Sushabhan Sadhukhan

Version 1 posted 18 May 2020

1,140

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Organic Chemistry

Working Paper

A new family of rigid C2-symmetric cleft molecules as potential medicinal chemistry scaffolds

Marc Kimber, Gazalah Elgadi, Mark Elsegood, Miheal Patel, Paulo Netz, Tiago de Oliveira

Version 2 posted 11 July 2022

499

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Biological and Medicinal Chemistry

Working Paper

In Silico Molecular Dynamics Docking of Drugs to the Inhibitory Active Site of SARS-CoV-2 Protease and Their Predicted Toxicology and ADME

Leif Peterson

Version 1 posted 23 April 2020

1,131

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Biological and Medicinal Chemistry

Working Paper

Modification of Remdesivir as a Better Inhibitor of COVID-19: A Computational Docking Study

Mita Shikder, Kazi Ahsan Ahmed, Tasnin Al Hasib, Md. Lutful Kabir

Version 1 posted 01 September 2020

848

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Biological and Medicinal Chemistry

Working Paper

Potential inhibitors against papain-like protease of novel coronavirus (SARS-CoV-2) from FDA approved drugs

Rimanshee Arya, Amit Das, Vishal Prashar, Mukesh Kumar

Version 2 posted 20 February 2020

8,792

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21 results in docking studies in Keywords: docking studies

A NOVEL COMPUTATIONALLY DESIGNED DRUG TO TREAT THE COVID -19 PANDEMIC

Molecular Docking study of Receptor Binding Domain of SARS-CoV-2 Spike Glycoprotein with Saikosaponin, a Triterpenoid Natural Product

Comprehensive Virtual Screening of the Antiviral Potentialities of Marine Polycyclic Guanidine Alkaloids against SARS-CoV-2 (Covid-19)

Structure-Based Screening of Potential Triterpenoids for Anti-Viral Activity Against SARS-CoV-2 and Related Coronaviruses

Cheminformatics Modeling of Closantel Analogues for Treating River Blindness

Plant-Derived Natural Polyphenols as Potential Antiviral Drugs Against SARS-CoV-2 via RNA‐dependent RNA Polymerase (RdRp) Inhibition: An In-Silico Analysis

A new family of rigid C2-symmetric cleft molecules as potential medicinal chemistry scaffolds

In Silico Molecular Dynamics Docking of Drugs to the Inhibitory Active Site of SARS-CoV-2 Protease and Their Predicted Toxicology and ADME

Modification of Remdesivir as a Better Inhibitor of COVID-19: A Computational Docking Study

Potential inhibitors against papain-like protease of novel coronavirus (SARS-CoV-2) from FDA approved drugs

21 results in Keywords: docking studies