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Structure based prediction of subtype-selectivity for adenosine receptor antagonists
 

Summary: Structure based prediction of subtype-selectivity for adenosine
receptor antagonists
Vsevolod Katritch, Irina Kufareva, Ruben Abagyan*
University of California, San Diego Skaggs School of Pharmacy and Pharmaceutical Sciences, 9500 Gilman Drive, MC-0747, La Jolla, CA 92093 USA
a r t i c l e i n f o
Article history:
Received 27 April 2010
Received in revised form
1 July 2010
Accepted 7 July 2010
Keywords:
GPCR
G protein-coupled receptor
Adenosine receptor
Subtype selectivity
Homology modeling
Ligand docking
Conformational sampling
Structure based drug discovery
a b s t r a c t

  

Source: Abagyan, Ruben - School of Pharmacy and Pharmaceutical Sciences, University of California at San Diego

 

Collections: Biology and Medicine