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A facile synthesis, characterization, DFT, ADMET and in-silico molecular docking analysis of novel 4-ethyl acridine-1,3,9 (2,4,10H)-trione
by
Jayavel, Prakash
,
Ramasamy, Venkateswaramoorthi
,
Amaladoss, Nepolraj
,
Renganathan, Vijayakumar
,
Shupeniuk, Vasyl I
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Chemical physics impact
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Synthesis of new 3‐(hydroxymethyl)‐2‐phenyl‐2,3 dihydroquinolinone and in‐silico evaluation of COVID‐19 main protease inhibitor
by
Nepolraj, Amaladoss
,
Shupeniuk, Vasyl I
,
Sathiyaseelan, Manisekar
,
Prakash, Nagamuthu
Published in
Vietnam Journal of Chemistry
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Single crystal, conformational, quantum reactivity, hirshfeld surface, molecular interactions, ADMET, and molecular docking investigations on HIV-1 site of 3-isopropyldiphenyl-1-(2...
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Amaladoss, Nepolraj
,
Ramasamy, Venkateswaramoorthi
,
Kuppusamy, Krishnasamy
Published in
Journal of molecular structure
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Design, one-pot novel synthesis of substituted acridine derivatives: DFT, structural characterisation, ADME and anticancer DNA polymerase epsilon molecular docking studies
by
Jayavel, Prakash
,
Rajamanickam, Ramachandran
,
Amaladoss, Nepolraj
,
Ramasamy, Venkateswaramoorthi
,
Shupeniuk, Vasyl I.
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Molecular physics
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Synthesis, spectroscopic, SC-XRD, DFT, RAHBs, RDG, molecular docking and in vitro anticancer evaluation of ethyl 1,2,5,6-tetrahydro-4‑hydroxy-2,6-diphenylpyridine-3-carboxylate
by
Sampathkumar, Jayanthi
,
Dalavi, Pandurang Appana
,
Venkatesan, Jayachandran
,
Amaladoss, Nepolraj
,
Rajamanickam, Ramachandran
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Journal of molecular structure
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Journal Of Molecular Structure
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Vietnam Journal Of Chemistry
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