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SASTRA Deemed University
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Publications (183)
- A concise and highly diastereoselective one-pot synthesis of vicinal tetrasubstituted furofuran analogues Save
- Adamantane-linked 1,2,4-triazoles: Crystal structures, in vitro antimicrobial and anti-proliferative activities, and molecular docking analysis Save
- Comments on “influence of procion red dye doping on the structural, dielectric and optical properties of diglycine phthalic acid single crystals for nonlinear optical applications” Save
- Corrigendum to “Evaluation of charge assisted hydrogen bonds in L-(S)-lysinium L-(S)-mandelate dihydrate and L-(S)-alanine L-(S)-mandelic acid complexes: Inputs from Hirshfeld surface, PIXEL energy and QTAIM analysis” [Journal of Molecular Structure 1220… Save
- Crystal structure and computational analysis of 1,3-dioxo-2-phenyl-2,3-dihydro-1H-pyrrolo[3,4-c]quinoline 5-oxide, a caspase-3 inhibitor Save
- Crystallographic and computational insights into charge-assisted N/C–H···Br− hydrogen bonding in 2-Amino-1-alkylpyridinium bromide salts Save
- Evaluation of charge-assisted hydrogen bonds and weak intermolecular interaction in trimethoprim 2-aminobenzoate: A combined crystallographic and theoretical approach Save
- Experimental and computational investigations of two N′-(adamantan-2-ylidene)-substituted benzohydrazide derivatives: crystal structures, antiproliferative activity, molecular docking, and molecular dynamics simulations Save
- Exploration of charge-assisted hydrogen bonds and weak intermolecular interaction networks in 1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium hydrogen (2-methacrylamidophenyl)arsonate: Insights from crystallographic, PIXEL energy, and QTAIM analyses Save
- Generative adversarial network (GAN) model-based design of potent SARS-CoV-2 Mpro inhibitors using the electron density of ligands and 3D binding pockets: insights from molecular docking, dynamics simulation, and MM-GBSA analysis Save