View Profile

Dr. M. THIRUNAVUKKARASU

Assistant profesor · Vel Tech Rangarajan Dr Sagunthala R&D Institute of Science and Technology

https://researchid.co/thiru2526
@veltech.edu.in
31Scopus Publications
368Google Scholar Citations
11Google Scholar h-index
13Google Scholar i10-index

Research Interests

DFT, Spectroscopic studies, Molecular Docking, Non-Covalent interaction studies, NLO

Recent Scopus Publications

  1. Pharmacokinetics and molecular-level insights into 5-Methyl-3-(trifluoromethyl)-1H-pyrazole for anticancer action: Spectroscopic profiling, solvent interactions, topological analysis and ADME–QSAR predictions
    Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy, 2026
  2. Anticancer potential of Thalassia hemprichii bioactive compounds against breast cancer with insights from molecular docking and network pharmacology
    Food Bioscience, 2025
  3. A theoretical investigation into the impact of solvents (alkanolic and non-alkanolic), structural and spectroscopic properties, donor-acceptor insights, Hirshfeld surface, and molecular docking of the anti-tumor compound (2E)-3-[4-(dimethylamino)phenyl]-1-(3-nitrophenyl)prop‑2-en-1-one
    Journal of Molecular Structure, 2025
  4. Exploring the potential of diosgenin as a promising antitumor agent through comprehensive spectroscopic characterization, solvent–solute interactions, topological properties, Hirshfeld surface, and molecular docking interactions with 2NZT and 2I1V proteins
    Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy, 2025
  5. Experimental and theoretical investigations of prifinium bromide: structural insights, spectroscopic features, topological aspects, and biological properties
    International Journal of Applied Science and Engineering, 2025

Links