Search Results - "Chitara, Dheeraj"
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Physiological models to study the effect of molecular crowding on multi-drug bound proteins: insights from SARS-CoV-2 main protease
Published in Journal of biomolecular structure & dynamics (01-01-2022)“…Molecular Dynamics simulations are often used in drug design. However, such simulations do not account for the physiological environment of the receptor; hence…”
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Targeting allosteric pockets of SARS-CoV-2 main protease Mpro
Published in Journal of biomolecular structure & dynamics (22-09-2022)“…Repurposing of antivirals is an attractive therapeutic option for the treatment of COVID-19. Main protease (M pro ) , also called 3 C-like protease (3CL pro )…”
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Molecular crowding and conserved interface interactions of human argonaute protein-miRNA-target mRNA complex
Published in Journal of biomolecular structure & dynamics (22-11-2021)“…RNA interference (RNAi) has been of interest given its role in genetic interference. More significantly, recent studies provided evidence of it being one of…”
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Targeting allosteric pockets of SARS-CoV-2 main protease M pro
Published in Journal of biomolecular structure & dynamics (22-09-2022)Get full text
Journal Article -
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Targeting allosteric pockets of SARS-CoV-2 main protease M pro
Published in Journal of biomolecular structure & dynamics (27-02-2021)“…Repurposing of antivirals is an attractive therapeutic option for the treatment of COVID-19. Main protease (M , also called 3 C-like protease (3CL ) is a key…”
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Journal Article