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Abstract
We provide results from a molecular dynamics simulation of the SARS-CoV-2 main protease in the monomer and dimer states of the native enzyme and also bound to a peptide substrate.
SARS-CoV-2 Main Protease: A Molecular Dynamic Study
27 May 2020, Version 1
Working Paper
Authors
This content is a preprint and has not undergone peer review at the time of posting.
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Now Published
SARS-CoV-2 Main Protease: A Molecular Dynamics Study [opens in a new tab]
Dimas Suárez, Natalia Díaz journal article
Journal of Chemical Information and Modeling , Volume 60, Issue 12
Online publication date: Jul 17, 2020
Version History
May 27, 2020 Version 1
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Funding
European Commission
1326
FICYT - FUNDACION PARA EL FOMENTO EN ASTURIAS DE LA INVESTIGACION CIENTIFICA APLICADA Y LA TECNOLOGIA
Author’s competing interest statement
No conflict of interest