F. Rizwana B.

Computational evaluation of the reactivity and pharmaceutical potential of an organic amine: A DFT, molecular dynamics simulations and molecular docking approach

S. Muthu, Stevan Armaković, J. Prasana, 2019, Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy.

Spectroscopic (FT-IR, FT Raman and UV-Vis), Quantum Computational and Molecular Docking studies on Propylthiouracil

S. Muthu, J. Prasana, F. Rizwana B., 2021, Analytical Chemistry Letters.

Spectroscopic (FT-IR, FT-Raman) investigation, topology (ESP, ELF, LOL) analyses, charge transfer excitation and molecular docking (dengue, HCV) studies on ribavirin

Christina Susan Abraham, J. Prasana, C. Abraham, 2018, Chemical Data Collections.

Wavefunction analysis, charge transfer and molecular docking studies on famciclovir and entecavir: Potential anti-viral drugs

S. Muthu, J. Prasana, C. Abraham, 2020 .