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Issue Date	Title	Author(s)
2023-04	Discovery of potent DNMT1 inhibitors against sickle cell disease using structural-based virtual screening, MM-GBSA and molecular dynamics simulation-based approaches	Murugesan, Sankaranarayanan
2023-07	Pharmacoinformatics-Based Approach for Uncovering the Quorum-Quenching Activity of Phytocompounds against the Oral Pathogen, Streptococcus mutans	Murugesan, Sankaranarayanan
2023-01	Molecular Docking and Dynamics Identifies Potential Repurposed Drug Candidates for COVID-19 Studies	Murugesan, Sankaranarayanan
2020-09	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
2022-12	Identification of Papain-Like Protease inhibitors of SARS CoV-2 through HTVS, Molecular docking, MMGBSA and Molecular dynamics approach	Murugesan, Sankaranarayanan
2021-09	Design, synthesis and evaluation of novel β-carboline ester analogues as potential anti-leishmanial agents	Murugesan, Sankaranarayanan
2023-11	In Silico Exploration of Bisphosphonate Scaffolds as Potential Inhibitors of SARS-CoV-2 RdRp for COVID-19 and PASC	Murugesan, Sankaranarayanan
2023	Molecular Docking and Dynamics Identify Potential Drugs to be Repurposed as SARS-CoV-2 Inhibitors	Murugesan, Sankaranarayanan
2023-07	In silico anti-viral assessment of phytoconstituents in a traditional (Siddha Medicine) polyherbal formulation – Targeting Mpro and pan-coronavirus post-fusion Spike protein	Murugesan, Sankaranarayanan
2022-01	Design, synthesis and structure–activity relationship studies of novel spirochromanone hydrochloride analogs as anticancer agents	Murugesan, Sankaranarayanan