Computational Insights On Charge Transfer and Non-covalent Interactions of Antibacterial Compound 4-dimethylaminopyridinium pyridine-2-carboxylate pentahydrate
Tarika, J.D. Deephlin, Dexlin, X.D. Divya, Arun kumar, A., Rathika, A, Jayanthi, D. Deva, Beaula, T. Joselin
Published in Journal of molecular structure (15.05.2022)
Published in Journal of molecular structure (15.05.2022)
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Journal Article
Effect of Charge Transfer and Non-Covalent Interactions of the Synthesized NLO Compound p-Nitrophenol Sodium-Bisulfate Using DFT Method
Shiny, C. L., Rathika, A., Tarika, J. D. Deephlin, Alen, S., Beaula, T. Joselin
Published in Polycyclic aromatic compounds (28.05.2023)
Published in Polycyclic aromatic compounds (28.05.2023)
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Journal Article
Insights into Spectral Elucidations, Reactivity Sites, Invitro Assay, Molecular Docking and Pharmacokinetic Studies of Non-Covalently Bonded 4-Aminobenzoic Acid 4-Nitroaniline
Dexlin, X. D. Divya, Tarika, J. D. Deephlin, Kumar, S. Madhan, Rathika, A., Beaula, T. Joselin
Published in Polycyclic aromatic compounds (15.03.2024)
Published in Polycyclic aromatic compounds (15.03.2024)
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Journal Article
Impact of Protonation and Hydrogen Bonding Interactions on the Biological Properties of Antibacterial Compound 4-Dimethylaminopyridinium Salicylate Monohydrate: Correlation with Its Precursor Molecules
Tarika, J. D. Deephlin, Dexlin, X. D. Divya, Rathika, A., Arun kumar, A., Jayanthi, D. Deva, Beaula, T. Joselin
Published in Polycyclic aromatic compounds (09.08.2023)
Published in Polycyclic aromatic compounds (09.08.2023)
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Journal Article
Physicochemical properties of organic non-linear optical (NLO) DL-alanine maleate (DLAM) single crystals
Rathika, A., Guru Prasad, L., Ganapathi Raman, R.
Published in Materials research innovations (01.04.2014)
Published in Materials research innovations (01.04.2014)
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Journal Article
Exploring the antibacterial activity of 1, 2 diaminoethane hexanedionic acid by spectroscopic, electronic, ELF, LOL, RDG analysis and molecular docking studies using DFT method
Vincy, C. Dabora, Tarika, J.D. Deephlin, Dexlin, X.D. Divya, Rathika, A., Beaula, T. Joselin
Published in Journal of molecular structure (05.01.2022)
Published in Journal of molecular structure (05.01.2022)
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Journal Article
Synthesis, spectroscopic investigations, topological non-covalent interactions, chemical reactivity, molecular docking and molecular dynamic simulation on piperazine succinate - A potential antimicrobial compound
Jeba Reeda, V.S., Divya, P., Suja, R., Rathika, A., Bena Jothy, V.
Published in Journal of molecular structure (15.11.2023)
Published in Journal of molecular structure (15.11.2023)
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Journal Article
Synthesis, spectroscopic analysis (FT-IR, FT-Raman, UV, NMR), non-covalent interactions (RDG, IGM) and dynamic simulation on Bis(8‑hydroxy quinoline) salicylate salicylic acid
R, Suja, Rathika, A., Reeda, V.S. Jeba, kumar, A. Arun, Divya, P.
Published in Journal of molecular structure (15.08.2024)
Published in Journal of molecular structure (15.08.2024)
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Journal Article
Spectroscopic Characterization, Quantum Chemical, Molecular Docking, Antibacterial and Anticancer Studies on Ethyl Coumarin-3-Carboxylate: an Antibacterial and Lung Cancer Agent
S. Mohan, Surya, Meera, M.R., Rathika, A., Premkumar, R.
Published in Polycyclic aromatic compounds (09.11.2023)
Published in Polycyclic aromatic compounds (09.11.2023)
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Journal Article
Leveraging the Photocatalytic Degradation Efficiency of Solution Combustion Derived ZnO Photocatalyst through Palladium Doping
Irine, T. M., Rathika, A., Gobalakrishnan, S., Isaac, R. S. Rimal, Sanjith, S., Chidhambaram, N.
Published in Crystal research and technology (1979) (01.08.2022)
Published in Crystal research and technology (1979) (01.08.2022)
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Journal Article
Insights into Weak and Covalent Interactions, Reactivity sites and Pharmacokinetic Studies of 4-Dimethylaminopyridinium Salicylate Monohydrate using Quantum Chemical Computation method
Tarika, J.D. Deephlin, Dexlin, X.D. Divya, kumar, A. Arun, Jayanthi, D. Deva, Rathika, A., Beaula, T. Joselin
Published in Computational and theoretical chemistry (01.12.2021)
Published in Computational and theoretical chemistry (01.12.2021)
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