Molecular dynamics simulation of the interaction of 5-keto substituted 7-tert-butyl-2 , 3-dihydro-3 , 3-dimethylbenzofuran derivatives with cyclooxygenase-2

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  2001

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• Deciphering the mechanism behind the varied binding activities of COXIBs through Molecular Dynamic Simulations, MM-PBSA binding energy calculations and per-residue energy decomposition studies

  2017cites this paper