Molecular docking and dynamics simulation of main protease of SARS-CoV-2 with naproxen derivative

Naproxen is a well-known anti-inflammatory drug that is frequently used to relieve inflammation, stiffness, and swelling. Naproxen has previously demonstrated antiviral activity, particularly against the influenza-A virus. There have been previous studies regarding naproxen effect on SARS-CoV-2 infe...

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Autores principales: K Hussein, Rageh, Marashdeh, Mohammad, M. El-Khayatt, Ahmed
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Biomedical Informatics 2023
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10563583/
https://www.ncbi.nlm.nih.gov/pubmed/37822838
http://dx.doi.org/10.6026/97320630019358
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author K Hussein, Rageh
Marashdeh, Mohammad
M. El-Khayatt, Ahmed
author_facet K Hussein, Rageh
Marashdeh, Mohammad
M. El-Khayatt, Ahmed
author_sort K Hussein, Rageh
collection PubMed
description Naproxen is a well-known anti-inflammatory drug that is frequently used to relieve inflammation, stiffness, and swelling. Naproxen has previously demonstrated antiviral activity, particularly against the influenza-A virus. There have been previous studies regarding naproxen effect on SARS-CoV-2 infection. Therefore, it is of interest to document the molecular docking and dynamics simulation data of main protease of SARS-CoV-2 with naproxen derivative for further consideration.
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spelling pubmed-105635832023-10-11 Molecular docking and dynamics simulation of main protease of SARS-CoV-2 with naproxen derivative K Hussein, Rageh Marashdeh, Mohammad M. El-Khayatt, Ahmed Bioinformation Research Article Naproxen is a well-known anti-inflammatory drug that is frequently used to relieve inflammation, stiffness, and swelling. Naproxen has previously demonstrated antiviral activity, particularly against the influenza-A virus. There have been previous studies regarding naproxen effect on SARS-CoV-2 infection. Therefore, it is of interest to document the molecular docking and dynamics simulation data of main protease of SARS-CoV-2 with naproxen derivative for further consideration. Biomedical Informatics 2023-04-30 /pmc/articles/PMC10563583/ /pubmed/37822838 http://dx.doi.org/10.6026/97320630019358 Text en © 2023 Biomedical Informatics https://creativecommons.org/licenses/by/3.0/This is an Open Access article which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly credited. This is distributed under the terms of the Creative Commons Attribution License.
spellingShingle Research Article
K Hussein, Rageh
Marashdeh, Mohammad
M. El-Khayatt, Ahmed
Molecular docking and dynamics simulation of main protease of SARS-CoV-2 with naproxen derivative
title Molecular docking and dynamics simulation of main protease of SARS-CoV-2 with naproxen derivative
title_full Molecular docking and dynamics simulation of main protease of SARS-CoV-2 with naproxen derivative
title_fullStr Molecular docking and dynamics simulation of main protease of SARS-CoV-2 with naproxen derivative
title_full_unstemmed Molecular docking and dynamics simulation of main protease of SARS-CoV-2 with naproxen derivative
title_short Molecular docking and dynamics simulation of main protease of SARS-CoV-2 with naproxen derivative
title_sort molecular docking and dynamics simulation of main protease of sars-cov-2 with naproxen derivative
topic Research Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10563583/
https://www.ncbi.nlm.nih.gov/pubmed/37822838
http://dx.doi.org/10.6026/97320630019358
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