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In silico approach to explore anti-chikungunya potential of Schiff’s bases with benzene and pyrimidine moieties - Chemical Papers

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By Asif Jamal, Zia Ud Din, Islamia College, Zaib us Sama
| link.springer.com
Abstract In this study, hydrazone derivatives (D1–D3) were synthesized aiming to evaluate its anti-chikungunya activity using in silico approach. Density functional theory calculation showed that the electronic density lies on the central aromatic rings of these molecules. Best confirmer, with minimum energy of these hydrazones, was selected for docking studies against the protein (PDB: ID 3gpg) to discover the anti-chikungunya potential.
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