Growth, spectral, optical, electrical and computational analysis of sodium oxalate single crystals

by R. Ramalakshmi, S. Stella Mary, S. Shahil Kirupavathy, S. Muthu, Renjith Thomas
Published 2021-03-01

DFT and molecular docking investigations of oxicam derivatives

by Y.Shyma Mary, Y.Sheena Mary, K.S. Resmi, Renjith Thomas
Published 2019-07-01

Detailed quantum mechanical, molecular docking, QSAR prediction, photovoltaic light harvesting efficiency analysis of benzil and its halogenated analogues

by Y. Shyma Mary, Y. Sheena Mary, K.S. Resmi, Veena S. Kumar, Renjith Thomas, B. Sureshkumar
Published 2019-11-01

Conformational profile, vibrational assignments, NLO properties and molecular docking of biologically active herbicide1,1-dimethyl-3-phenylurea

by K. Haruna, Veena S. Kumar, Y. Sheena Mary, S.A. Popoola, Renjith Thomas, M.S. Roxy, A.A. Al-Saadi
Published 2019-06-01

Detailed molecular structure (XRD), conformational search, spectroscopic characterization (IR, Raman, UV, fluorescence), quantum mechanical properties and bioactivity prediction of...

by Katta Eswar Srikanth, A. Veeraiah, T. Pooventhiran, Renjith Thomas, K. Anand Solomon, Ch.J. Soma Raju, J. Naveena Lavanya Latha
Published 2020-06-01

Phenolic and flavonoid contents in Malva sylvestris and exploration of active drugs as antioxidant and anti-COVID19 by quantum chemical and molecular docking studies

by Ahmad Irfan, Muhammad Imran, Muhammad Khalid, Muhammad Sami Ullah, Noreen Khalid, Mohammed A. Assiri, Renjith Thomas, S. Muthu, Muhammad Asim Raza Basra, Mohammed Hussein, Abdullah G. Al-Sehemi, Mohsin Shahzad
Published 2021-08-01