Druggability Assessment of Allosteric Proteins by Dynamics Simulations in the Presence of Probe Molecules

por Bakan, Ahmet, Nevins, Neysa, Lakdawala, Ami S., Bahar, Ivet
Publicado 2012

Calculated conformer energies for organic molecules with multiple polar functionalities are method dependent: Taxol (case study)

por Lakdawala, Ami, Wang, Minmin, Nevins, Neysa, Liotta, Dennis C, Rusinska-Roszak, Danuta, Lozynski, Marek, Snyder, James P
Publicado 2001