A combination of 3D-QSAR, docking, local-binding energy (LBE) and GRID study of the species differences in the carcinogenicity of benzene derivatives chemicals.
Fratev F, Benfenati E, J Mol Graph Model, 2008 Sep - link

Toxicity study of allelochemical-like pesticides by a combination of 3D-QSAR, docking, Local Binding Energy (LBE) and GRID approaches.
Fratev F, Lo Piparo E, Benfenati E, Mihaylova E, SAR QSAR Environ Res, 2007 Oct-Dec - link