K. Venkata Prasad

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

Effect of green solvents physical, chemical, biological and bonding nature on 5-acetyl-thiophene-2-carboxylic acid by DFT and TD-DFT approach – An antiviral agent

M. Sumithra, N. Sundaraganesan, K. Venkata Prasad et al. · Journal of the Indian Chemical Society · 2022 · 28 citations

Natural Sciences, Chemistry, Medicinal Chemistry +17

Spectroscopic (FT-IR, FT-Raman, UV–Visible) and quantum chemical studies of 4-Chloro-3-iodobenzophenone

K. Venkata Prasad, S. Muthu, C. Santhamma · Journal of Molecular Structure · 2016 · 20 citations

Natural Sciences, Chemistry, Physics +14

Molecular Structure, Vibrational Spectroscopic (FT-IR, FT-Raman), First Order Hyperpolarizability, NBO Analysis, HOMO and LUMO Analysis, Thermodynamic Properties of 3,5-Dimethylbenzophenone by Ab Initio HF and Density Functional Method

Kadali Chaitanya, C. Santhamma, K. Venkata Prasad et al. · The Journal of Atomic and Molecular Sciences · 2011 · 16 citations

Natural Sciences, Chemistry, Physics +17

Spectroscopic studies (FT-IR, FT-Raman, UV–Visible), normal co-ordinate analysis, first-order hyperpolarizability and HOMO, LUMO studies of 3,4-dichlorobenzophenone by using Density Functional Methods

K. Venkata Prasad, K. Samatha, D. Jagadeeswara Rao et al. · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2015 · 16 citations

Natural Sciences, Chemistry, Physics +16