Items where Author is "Lohith, T. N."

Vinay Kumar, D. C. and Chethan, B. S. and Neetha, S. and Darshini Gowda and Shalini, V. and Lohith, T. N. and Rangappa, K. S. and Lokanath, N. K. (2026) Comprehensive analysis of triazolothiadiazole derivative: From synthesis and crystal structure to quantum chemical and molecular simulation studies on JAK2 protein. Journal of Molecular Structure, 1353. p. 144689. ISSN 1872-8014

Darshan, D. and Santhosh, C. and Singh, Ravi K. and Chethan, B. S. and Lohith, T. N. and Sadashiva, M. P. and Sunil, K. and Hemalatha, P. (2026) Synthesis, structural elucidation, Hirshfeld surface, DFT, pharmacophore, and in silico studies of a piperonal derivative: A study based on experimental and theoretical methods. Journal of Molecular Structure, 1352. p. 144555. ISSN 1872-8014

Chandra and Lohith, T. N. and Gayathri, B. H. and Feizi-Dehnayebi, M. and Karthik and Kumar, S. and Divya, K. and Sridhar, M. A. and Mahendra, M. and Ziarani, G. M. (2025) In-silico studies of 3- tert -butyl-7-[2-phenyl ethenyl]-4 H -[1,3,4]thiadiazolo[2,3- c ][1,2,4] triazin-4-one as a Potential SARS-CoV-2 Inhibitor: Insights from an experimental and computational approach. Journal of Molecular Structure, 1330. ISSN 0022-2860

Doreswamy, S. and Santhosh, C. and Lohith, T. N. and Neetha, S. and Sharath, K. and Sridhar, M. A. and Sadashiva, M. P. (2025) The study of the role of non-covalent interactions (C-H⋯N, CH⋯π, C-O⋯C-O, and π⋯π) towards crystal packing of benzyl 4-(4-flurophenyl)thiazole-2-carboxylate: A combined experimental and computational approach. Journal of Molecular Structure, 1329. ISSN 0022-2860

Doreswamy, S. and Santhosh, C. and Lohith, T. N. and Neetha, S. and Sharath, K. and Sridhar, M. A. and Sadashiva, M. P. (2025) The study of the role of non-covalent interactions (C-H⋯N, CH⋯π,C-O⋯C-O, and π⋯π) towards crystal packing of benzyl 4-(4-flurophenyl)thiazole-2-carboxylate: A combined experimental and computational approach. Journal of Molecular Structure, 1329. ISSN 0022-2860

Chandini, K. M. and Al-Ostoot, Fares Hezam and Lohith, T. N. and Al-Gunaid, Murad Q. A. and Al-Maswari, Basheer M. and Sridhar, M. A. and Shaukath Ara Khanum (2022) Synthesis, structure elucidation, Hirshfeld surface analysis, energy frameworks and DFT studies of novel ethyl 2-(5-methyl-2-oxopyridin-N-yl)acetate (OPA). Journal of Molecular Structure, 1270. ISSN 1872-8014