Optimal scaling factors for CM1 and CM3 atomic charges in RM1-based aqueous simulations. - Jonah Z. Vilseck; Somisetti V. Sambasivarao; Orlando Acevedo (J. Comput. Chem., 2011)

Computational Insight into Small Molecule Inhibition of Cyclophilins. - Somisetti V. Sambasivarao; Orlando Acevedo (J. Chem. Inf. Model., 2011)