Design of novel alpha7-subtype-preferring nicotinic acetylcholine receptor agonists: application of docking and MM-PBSA computational approaches, synthetic and pharmacological studies.
Grazioso G, Pome DY, Matera C, Frigerio F, Pucci L, Gotti C, Dallanoce C, De Amici M, Bioorg Med Chem Lett, 2009 Nov 15 - link

Insights into docking and scoring neuronal alpha4beta2 nicotinic receptor agonists using molecular dynamics simulations and QM/MM calculations.
Sgrignani J, Bonaccini C, Grazioso G, Chioccioli M, Cavalli A, Gratteri P, J Comput Chem, 2009 Nov 30 - link