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Diversity-property derived DPD method

The Diverse Property-Derived method (DPD method) is based on the partitioning of six noncorrelated molecular descriptors and physico-chemical properties [Ashton, Jaye et al, 1996]. These are a lipophilicity descriptor (CLOGP), an electrotopological index calculated as normalized sum of the squares of the atomic electrotopological state indices, the number of hydrogen-bond acceptors (HBA), the number of hydrogen-bond donors (HBD), a flexibility index defined as the ratio of the —> Kier shape descriptors over k, and the aromatic density defined as the number of aromatic rings over the molecular volume (Table Cl). [Pg.87]

DPD method = Diverse Property-Derived method —> cell-based methods... [Pg.232]


See other pages where Diversity-property derived DPD method is mentioned: [Pg.355]    [Pg.47]    [Pg.264]    [Pg.23]    [Pg.264]    [Pg.355]    [Pg.47]    [Pg.264]    [Pg.23]    [Pg.264]    [Pg.531]   
See also in sourсe #XX -- [ Pg.201 , Pg.203 ]

See also in sourсe #XX -- [ Pg.201 , Pg.203 ]




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DPD

DPD method

Derivative method

Derivative properties

Method diverse property-derived

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