Virtual screening, molecular interaction field, molecular dynamics, docking, density functional, and ADMET properties of novel AChE inhibitors in Alzheimer's disease.
da Silva CH, Carvalho I, Taft CA, J Biomol Struct Dyn, 2007 Jun - link

Molecular modeling, docking and ADMET studies applied to the design of a novel hybrid for treatment of Alzheimer's disease.
da Silva CH, Campo VL, Carvalho I, Taft CA, J Mol Graph Model, 2006 Oct - link