R. Niranjana Devi

Evaluation of electronic and biological interactions between N-[4-(Ethylsulfamoyl)phenyl]acetamide and some polar liquids (IEFPCM solvation model) with Fukui function and molecular docking analysis

Gnana Bharathy, Johanan Christian Prasana, S. Muthu et al. · Journal of Molecular Liquids · 2021 · 85 citations

Natural Sciences, Biophysics, Chemistry +17

Spectroscopic, quantum mechanical, electronic excitation properties (Ethanol solvent), DFT investigations and molecular docking analysis of an anti-cancer drug Bendamustine

P. Venkata Ramana, Tom Sundius, S. Muthu et al. · Journal of Molecular Structure · 2021 · 38 citations

Natural Sciences, Chemistry, Medicinal Chemistry +17

Charge density analysis of metformin chloride, a biguanide anti-hyperglycemic agent

R. Niranjana Devi, Christian Jelsch, S. Israel et al. · Acta Crystallographica Section B Structural Science Crystal Engineering and Materials · 2017 · 27 citations · Full text

Natural Sciences, Chemistry, Medicinal Chemistry +17

RETRACTED: Quantum computational studies on optimization, donor-acceptor analysis and solvent effect on reactive sites, global descriptors, non-linear optical parameters of Methyl N-Boc-piperidine-3-carboxylate

M. Vimala, S. Stella Mary, Rongala Ramalakshmi et al. · Journal of Molecular Liquids · 2021 · 27 citations

Natural Sciences, Chemistry, Physics +17

Topological and electrostatic properties of diclofenac molecule as a non-steroidal anti-inflammatory drug: An experimental and theoretical study

R. Niranjana Devi, P. Justin, Piero Macchi et al. · Journal of Molecular Structure · 2019 · 24 citations · Full text

Natural Sciences, Medicinal Chemistry, Pharmacology +10