| Coumarin-Benzothiazole Based Azo Dyes: Synthesis, Characterization, Computational, Photophysical and Biological Studies Manjunatha B, Yadav D Bodke, Nagaraja O, Lohith TN, Nagaraju G, Sridhar MA Journal of Molecular Structure 1246, 131170, 2021 | 53 | 2021 |
| Novel Isoxazolone Based Azo Dyes: Synthesis, Characterization, Computational, Solvatochromic UV-Vis Absorption and Biological Studies Manjunath B, Yadav D. Bodke, Sandeep kumar jain R, Lohith T N, Sridhar M A Journal of Molecular Structure, 130933, 2021 | 50 | 2021 |
| Design, synthesis, molecular docking and DFT computational insight on the structure of Piperazine sulfynol derivatives as a new antibacterial contender against superbugs MRSA HSN Prasad, AP Ananda, TN Lohith, P Prabhuprasad, HS Jayanth, ... Journal of Molecular Structure 1247, 131333, 2022 | 31 | 2022 |
| Synthesis, molecular structure, Hirshfeld surface, energy framework and DFT studies of 1, 3, 4 oxadiazole derivative TN Lohith, S Shamanth, MA Sridhar, K Mantelingu, NK Lokanath Journal of Molecular Structure 1252, 132203, 2022 | 29 | 2022 |
| Persistent prevalence of non-covalent interaction in pyrimidine containing sulfonamide derivative: A quantum computational analysis TN Lohith, MK Hema, CS Karthik, S Sandeep, L Mallesha, NS Alsaiari, ... Journal of Molecular Structure 1266, 133378, 2022 | 28 | 2022 |
| N-[2-(5-bromo-2-chloro-pyrimidin-4-yl) thio)-4-methoxy-phenyl]-4-chlorobenzenesulfonamide: The existence of H-bond and halogen bond interactions assisted supramolecular … TN Lohith, MK Hema, CS Karthik, S Sandeep, L Mallesha, P Mallu, ... Journal of Molecular Structure 1267, 133476, 2022 | 22 | 2022 |
| SARS-CoV-2 Mpro binding profile and drug-likeness of two novel thiazole derivatives: structural elucidation, DFT studies, ADME-T and molecular docking simulations SMP Lohith T.N., Ravi Singh K., Bienfait Kabuyaya Isamura, Vinay Kumar K.S ... Journal of Biomolecular Structure and Dynamics 41, 1-15, 2022 | 11* | 2022 |
| Synthesis, characterizations of new Schiff base heterocyclic derivatives and their optoelectronic, computational studies with level II & III features of LFPs K Upendranath, T Venkatesh, TN Lohith, MA Sridhar Journal of Molecular Structure 1264, 133231, 2022 | 11 | 2022 |
| Synthesis, structure elucidation, Hirshfeld surface analysis, energy frameworks and DFT studies of novel ethyl 2-(5-methyl-2-oxopyridin-N-yl) acetate (OPA) KM Chandini, FH Al-Ostoot, TN Lohith, MQA Al-Gunaid, BM Al-Maswari, ... Journal of Molecular Structure 1270, 133928, 2022 | 8 | 2022 |
| Physico-chemical analysis of selected groundwater samples of Tumkur district, Karnataka. B Nirmala, PA Suchetan, D Darshan, AG Sudha, TN Lohith, E Suresh, ... | 8 | 2013 |
| Antibacterial Property of Schiff-based Piperazine against MRSA: Design, Synthesis, Molecular Docking, and DFT Computational Studies HSN Prasad, NP Gaonkar, AP Ananda, A Mukarambi, GC Kumar, ... Lett. Appl. NanoBioScience 2, 54, 2022 | 7 | 2022 |
| Probing the hydrogen bond network in the crystal structure of a sulfonamide derivative: A quantum chemical approach TN Lohith, MK Hema, CS Karthik, S Sandeep, JR Rajabathar, M Karnan, ... Journal of Molecular Structure 1289, 135841, 2023 | 6 | 2023 |
| Synthesis, structure elucidation, energy frameworks, and DFT calculations of 2, 5-diphenyl-1, 3, 4-thiadiazole KM Chandini, TN Lohith, S Shamanth, MA Sridhar, K Mantelingu, ... Journal of Molecular Structure 1283, 135320, 2023 | 6 | 2023 |
| Crystal structure studies, Hirshfeld surface analysis, 3D energy frameworks, computational studies and docking analysis of a 2-(4-nitrophenyl)-2-oxoethyl 2-methoxybenzoate D Sahana, CS Dileep, TN Lohith, P Akhileshwari, N Srikantamurthy, ... Journal of Molecular Structure 1282, 135215, 2023 | 4 | 2023 |
| Structure property relationship in two thiazole derivatives: Insights of crystal structure, Hirshfeld surface, DFT, QTAIM, NBO and molecular docking studies K Ravi Singh, TN Lohith, T Ananth Nag, MA Sridhar, MP Sadashiva Molecular Crystals and Liquid Crystals 763 (1), 54-72, 2023 | 3 | 2023 |
| Synthesis and detailed characterization of a newly synthesized chalcone, 3-(2,5-dimethoxyphenyl)-1-(naphthalen-2-yl)prop-@-ene-1-one MDJ Madhu Kumar D.J., Akhileshwari P., Sridhar M.A., Lohith T N., Nagaraju S ... European Journal of Chemistry 12, 69-76, 2021 | 3 | 2021 |
| Ordering self-assembly structures via NH⋯ S and Br⋯ S interactions in (E)-2-(4-bromobenzylidene) hydrazinecarbothioamide: Insights from crystallographic and computational study V Kumar, S Kumar Journal of Molecular Structure 1310, 138285, 2024 | 2 | 2024 |
| Synthesis of citral-tryptamine fused selenium nanospheres (CT@ SeNP's) and exploration of their anticancer, antibacterial, and electrochemical sensor applications BS Hemanth, MJ Deviprasad, MB Shivaswamy, S Sumathi, R Aswathy, ... Journal of Molecular Structure 1310, 138240, 2024 | 2 | 2024 |
| Molecular iodine catalyzed solvent free one pot Synthesis, Characterization, Insilico Adme, Herg Analysis, Molecular Docking Studies and DFT Analysis of 2-substituted 4, 5 … K Pruthviraj, TN Lohith, M Yeshwanth, GH Usha, HV Vanajakshi, ... Journal of Advanced Scientific Research 12 (04), 211-229, 2021 | 2 | 2021 |
| Synthesis, crystal structure, Hirshfeld surface analysis, energy frameworks, and DFT calculations of (2e)-3-(dimethylamino)-1-[5-methyl-1-(4-nitrophenyl)-1h-1,2,3 … MK Usha, TN Lohith, M Manjula, S Shetty, B Kalluraya, ... Molecular Crystals and Liquid Crystals 768 (6), 11-26, 2024 | 1 | 2024 |
