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Biological and Medicinal Chemistry

Working Paper

Vertical flow immunoassay based on carbon black nanoparticles for the detection of IgG against SARS-CoV-2 Spike-protein in human serum: proof-of-concept

Mariya Kropaneva, Pavel Khramtsov, Mariya Bochkova, Sergey Lazarev, Dmitriy Kiselkov, Mikhail Rayev

Version 1 posted 29 June 2023

97

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1

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Biological and Medicinal Chemistry

Working Paper

Structure-Guided Design of Potent Inhibitors of SARS-CoV-2 3CL Protease: Structural, Biochemical, and Cell-Based Studies.

Chamandi Dampalla, Athri D. Rathnayake, Krishani Dinali Perera, Abdul-Rahman M. Jesri, Harry Nhat Nguyen, Matthew J. Miller, Hayden A. Thurman, Jian Zheng, Maithri Kashipathy, Kevin P. Battaile, Scott Lovell, Stanley Perlman, Yunjeong Kim, William C. Groutas, Kyeong-Ok Chang, Chamandi Shashikala Dampalla Gamachchige

Version 1 posted 15 June 2021

433

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Biological and Medicinal Chemistry

Working Paper

Naringenin-7-O-glucoside: Targeting SERPINE1, MMP7, and MMP1 for COVID-19 Lung Pathology and Immune Modulation

Vibha Mishra, Shivangi Agrawal, Divya Malik, Ekta Pathak, Rajeev Mishra

Version 1 posted 28 December 2023

122

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Theoretical and Computational Chemistry

Working Paper

Impact of warhead modulations on the covalent inhibition of SARS-CoV-2 Mpro explored by QM/MM simulations

Sergio Marti, Kemel Arafet, Alessio Lodola, Adrian Mulholland, Katarzyna Swiderek, Vicent Moliner

Version 1 posted 11 August 2021

301

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Theoretical and Computational Chemistry

Working Paper

Exploring the Mechanism of the Envelope Protein of SARS-CoV-2: A Molecular Dynamics Study

Sanika Dolas, Gaurav Sharma

Version 1 posted 06 November 2023

138

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Biological and Medicinal Chemistry

Working Paper

Active learning guided drug design lead optimization based on relative binding free energy modeling

Filipp Gusev, Evgeny Gutkin, Maria G. Kurnikova, Olexandr Isayev

Version 1 posted 11 July 2022

2,104

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3

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Biological and Medicinal Chemistry

Working Paper

Unlocking the Genetic Mysteries of SARS-CoV-2: A Deep Dive into the Sequence, Structure, and Dynamics of Mpro Mutations

MOHD KHAN

Version 1 posted 27 December 2023

58

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Theoretical and Computational Chemistry

Working Paper

Computational Estimation of Potential Inhibitors from the Known Drugs against the Main Protease of SARS-CoV-2

Nguyen Minh Tam, Pham Minh Quan, Nguyen Xuan Ha, Pham Cam Nam, Huong Thi Thu Phung

Version 1 posted 25 February 2021

389

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8 results in SARS-CoV-2 Mpro inhibitors, COVID-19 in Keywords: SARS-CoV-2 Mpro inhibitors, COVID-19

Vertical flow immunoassay based on carbon black nanoparticles for the detection of IgG against SARS-CoV-2 Spike-protein in human serum: proof-of-concept

Structure-Guided Design of Potent Inhibitors of SARS-CoV-2 3CL Protease: Structural, Biochemical, and Cell-Based Studies.

Naringenin-7-O-glucoside: Targeting SERPINE1, MMP7, and MMP1 for COVID-19 Lung Pathology and Immune Modulation

Impact of warhead modulations on the covalent inhibition of SARS-CoV-2 Mpro explored by QM/MM simulations

Exploring the Mechanism of the Envelope Protein of SARS-CoV-2: A Molecular Dynamics Study

Active learning guided drug design lead optimization based on relative binding free energy modeling

Unlocking the Genetic Mysteries of SARS-CoV-2: A Deep Dive into the Sequence, Structure, and Dynamics of Mpro Mutations

Computational Estimation of Potential Inhibitors from the Known Drugs against the Main Protease of SARS-CoV-2

8 results in Keywords: SARS-CoV-2 Mpro inhibitors, COVID-19