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** Density functional calculation calculations **

Dichloroethane Didecyldimethylammonium bromide Density function theoretical (calculations) [Pg.272]

Park JY, Harris D. Construction and assessment of models of CYP2E1 predictions of metabolism from docking, molecular dynamics, and density functional theoretical calculations. J Med Chem 2003 46 1645-1660. [Pg.464]

See also in sourсe #XX -- [ Pg.64 , Pg.75 , Pg.85 , Pg.90 , Pg.94 , Pg.97 , Pg.98 , Pg.121 , Pg.140 ]

** Density functional calculation calculations **

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