One-pot synthesis, NMR, quantum chemical approach, molecular docking studies, drug-likeness and in-silico ADMET prediction of novel 1-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-(furan... von Rajaraman, D., Anthony, L. Athishu, Nethaji, P., Vallangi, Ravali

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Synthesis, crystal structure, Hirshfeld surface analysis, DFT, molecular docking and molecular dynamic simulation studies of (E)-2,6-bis(4-chlorophenyl)-3-methyl-4-(2-(2,4,6-trichl... von Anthony, L. Athishu, Rajaraman, D., Sundararajan, G., Suresh, M., Nethaji, P., Jaganathan, R., Poomani, Kumaradhas

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One-pot synthesis, Spectral, X-ray crystal structure, Hirshfeld surface and computational study on potential inhibitory action of novel 1-benzyl-2-(4-methoxynaphthalen-1-yl)-4,5-di... von Anthony, L. Athishu, Nethaji, P., Sundararajan, G., Rajaraman, D.

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One-pot synthesis, NMR, quantum chemical approach, molecular docking studies, drug-likeness and in-silico ADMET prediction of novel 1-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-(furan... von Rajaraman, D, Anthony, L Athishu, Nethaji, P, Vallangi, Ravali

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Synthesis, NMR, anti-oxidant, anti-cancer activity, Molecular docking, DFT Calculations and in silico ADME analysis of 3′-benzoyl-4′-phenyl-5′-(piperazin-1-ylmethyl)spiro[indoline-... von Rajaraman, D., Anthony, L. Athishu, Sundararajan, G., Shanmugam, M., Arunkumar, A.

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N'-(3,4-dimethoxybenzylidene)-4-methylbenzenesulfonohydrazide derivatives: Synthesis, quantum chemical method, in silico ADMET, molecular docking and molecular dynamic simulations von Lorin, Solo, Anthony, L. Athishu, Jaganathan, R., Kumaradhas, P., Rajaraman, D., Raja, K.

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In silico rationalization of piperidin-4-one analogs as anaplastic lymphoma kinase inhibitors: Integration of density functional theory, topological descriptor, molecular docking a... von Sonadevi, S., Rajaraman, D., Periyasami, G., Vijay, J. Sahaya, Roy, S., Augustine, Tony, Saritha, M., Anthony, L. Athishu

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Synthesis, spectral characterization, crystal examination, DFT method and molecular docking studies of 1-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-(thiophen-2-yl)-1H-phenanthro[9,10-... von Athishu Anthony, L., Nethaji, P., Rajaraman, D.

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SYNTHESIS, SPECTRAL, QUANTUM CHEMICAL METHOD, In-silico MOLECULAR DOCKING, AND ADMET ANALYSIS OF (E)-ISOBUTYL 2-(2-(4-CHLOROPHENYL) HYDRAZONO)-3- OXOBUTANOATE DERIVATIVES von Anthony, L. Athishu, R. Agilandeshwari, D. Deepak, V. Ravali, D. Rajaraman

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Synthesis, Spectral techniques, X-ray Crystal structure, DFT method, Hirshfeld surface analysis and Molecular docking studies of 1-(furan-2-yl)methyl)-4,5-diphenyl-2-(p-tolyl)-1H-i... von Anthony, L. Athishu, Rajaraman, D., Shanmugam, M., Krishnasamy, K.

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