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Discovery of potent DNMT1 inhibitors against sickle cell disease using structural-based virtual screening, MM-GBSA and molecular dynamics simulation-based approaches
Murugesan, Sankaranarayanan
(
Taylor & Francis
,
2023-04
)
Pharmacoinformatics-Based Approach for Uncovering the Quorum-Quenching Activity of Phytocompounds against the Oral Pathogen, Streptococcus mutans
Murugesan, Sankaranarayanan
(
MDPI
,
2023-07
)
Molecular Docking and Dynamics Identifies Potential Repurposed Drug Candidates for COVID-19 Studies
Murugesan, Sankaranarayanan
(
2023-01
)
Pharmacophore based virtual screening, molecular docking, molecular dynamics and MM-GBSA approach for identification of prospective SARS-CoV-2 inhibitor from natural product databases
Murugesan, Sankaranarayanan
(
Taylor & Francis
,
2020-09
)
Identification of Papain-Like Protease inhibitors of SARS CoV-2 through HTVS, Molecular docking, MMGBSA and Molecular dynamics approach
Murugesan, Sankaranarayanan
(
Elsevier
,
2022-12
)
Design, synthesis and evaluation of novel β-carboline ester analogues as potential anti-leishmanial agents
Murugesan, Sankaranarayanan
(
Taylor & Francis
,
2021-09
)
In Silico Exploration of Bisphosphonate Scaffolds as Potential Inhibitors of SARS-CoV-2 RdRp for COVID-19 and PASC
Murugesan, Sankaranarayanan
(
2023-11
)
Design, synthesis and structure–activity relationship studies of novel spirochromanone hydrochloride analogs as anticancer agents
Murugesan, Sankaranarayanan
(
Future Science Group
,
2022-01
)
Design, synthesis and evaluation of novel phenanthridine triazole analogs as potential antileishmanial agents
Murugesan, Sankaranarayanan
(
Future Science Group
,
2022-06
)
Graph theoretical network analysis, in silico exploration, and validation of bioactive compounds from Cynodon dactylon as potential neuroprotective agents against α-synuclein
Murugesan, Sankaranarayanan
(
Tabriz University of Medical Sciences
,
2022
)
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Murugesan, Sankaranarayanan (20)
Sundriyal, Sandeep (4)
Paul, Atish Tulshiram (3)
Garg, Mohit (2)
Jadhav, Hemant R. (2)
Deepa, P. R. (1)
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Molecular docking (29)
Pharmacy (29)
Molecular dynamics (9)
COVID-19 (6)
SARS-CoV-2 (5)
Molecular dynamics (MD) (4)
Pancreatic lipase (3)
Virtual screening (3)
Drug repurposing (2)
Enzyme inhibition (2)
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2023 (14)
2022 (7)
2024 (4)
2025 (2)
2020 (1)
2021 (1)
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