3D-QSAR studies of Dipeptidyl peptidase IV inhibitors using a docking based alignment.
Pissurlenkar RR, Shaikh MS, Coutinho EC, J Mol Model, 2007 Oct - link

Design of inhibitors of the MurF enzyme of Streptococcus pneumoniae using docking, 3D-QSAR, and de Novo design.
Khedkar SA, Malde AK, Coutinho EC, J Chem Inf Model, 2007 Sep-Oct - link