Zobrazeno 1 - 10 of 44 pro vyhledávání: '"Snehasis Chowdhuri"'
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Akademický článek
Effects of urea on the aqueous solvation structure and dynamics of cis/trans-N-methylformamide: An insight from molecular dynamics simulation study
Autor: Chinmay Parida, Pragin Chettiyankandy, Apramita Chand, Snehasis Chowdhuri
Publikováno v: Chemical Physics Impact, Vol 8, Iss , Pp 100448- (2024)
We have performed classical molecular dynamics simulation of aqueous cis/trans-N-methylformamide (NMF) systems in the presence of urea at 298 K by considering the Smith and Duffy models of urea with varying concentrations, ranging from 0 to 13.26 m.
Externí odkaz: https://doaj.org/article/6a937912917c4467b345bcf8b1628847
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2
Depicting the inhibitory potential of polyphenols from Isatis indigotica root against the main protease of SARS CoV-2 using computational approaches
Autor: Ashis Biswas, Snehasis Chowdhuri, Rajesh Ghosh, Ayon Chakraborty
Publikováno v: Journal of Biomolecular Structure & Dynamics
article-version (VoR) Version of Record
Journal of Biomolecular Structure and Dynamics
The pandemic disease COVID-19, caused by SARS CoV-2, has created a global crisis. Presently, researchers across the globe are in a quest to identify/develop drugs or vaccines by targeting different non-structural proteins (Nsps) of SARS CoV-2. One su
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ee9298e740107a748c174a87f3827f16
https://doi.org/10.1080/07391102.2020.1858164
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4
Computer aided identification of potential SARS CoV-2 main protease inhibitors from diterpenoids and biflavonoids of Torreya nucifera leaves
Autor: Snehasis Chowdhuri, Rajesh Ghosh, Ayon Chakraborty, Ashis Biswas
Publikováno v: Journal of Biomolecular Structure & Dynamics
article-version (VoR) Version of Record
Journal of Biomolecular Structure and Dynamics
SARS CoV-2 is the causative agent of the pandemic disease COVID-19. There is an urgent need for effective drugs or vaccines which can effectively combat this outbreak. The main protease (Mpro), a key component for the SARS CoV-2 replication, is consi
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::8955665b37a80cbc0216ebdbbbba84e8
https://doi.org/10.1080/07391102.2020.1841680
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8
Identification of polyphenols from Broussonetia papyrifera as SARS CoV-2 main protease inhibitors using in silico docking and molecular dynamics simulation approaches
Autor: Ayon Chakraborty, Ashis Biswas, Snehasis Chowdhuri, Rajesh Ghosh
Publikováno v: Journal of Biomolecular Structure and Dynamics
Journal of Biomolecular Structure & Dynamics
article-version (VoR) Version of Record
The current COVID-19 pandemic is caused by SARS CoV-2. To date, ∼463,000 people died worldwide due to this disease. Several attempts have been taken in search of effective drugs to control the spread of SARS CoV-2 infection. The main protease (Mpro
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::9357eed7bd16a0eaebffe76ce81dae21
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9
Evaluation of green tea polyphenols as novel corona virus (SARS CoV-2) main protease (Mpro) inhibitors - an
Autor: Rajesh, Ghosh, Ayon, Chakraborty, Ashis, Biswas, Snehasis, Chowdhuri
Publikováno v: Journal of Biomolecular Structure & Dynamics
Coronavirus disease 2019 (COVID-19) is a viral respiratory disease which caused global health emergency and announced as pandemic disease by World Health Organization. Lack of specific drug molecules or treatment strategy against this disease makes i
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=pmid________::0603e7bd74025ff3f2e52e1c599d00a4
https://pubmed.ncbi.nlm.nih.gov/32568613
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10
Evaluation of green tea polyphenols as novel corona virus (SARS CoV-2) main protease (Mpro) inhibitors – an in silico docking and molecular dynamics simulation study
Autor: Ashis Biswas, Snehasis Chowdhuri, Rajesh Ghosh, Ayon Chakraborty
Publikováno v: Journal of Biomolecular Structure and Dynamics
Coronavirus disease 2019 (COVID-19) is a viral respiratory disease which caused global health emergency and announced as pandemic disease by World Health Organization. Lack of specific drug molecules or treatment strategy against this disease makes i
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::8b46d8e65d936bc8557c5349ea2ac7cd
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