COMPTuesday, 28 March 2006

1:30 PM-4:45 PM Georgia World Congress Center -- B305, Oral
G-Protein Coupled Receptor Structure, Modeling, and Ligand Design
Organizers:John Woolfrey
Irache Visiers
1:30 PMHow bilayers cope with transmembrane helices: Insights from translocon-assisted helix insertion
Stephen H. White
2:00 PMAb initio modeling of the loops in G-protein coupled receptors
Ernest L. Mehler
2:30 PMStudying the photochemistry of retinal proteins with quantum chemical methods
Marcus Elstner
3:00 PMIntermission
3:15 PMModels for the GPCR proton sensors OGR1, GPR4, and TDAG8
Romain M. Wolf, Marie-Gabrielle Ludwig, Klaus Seuwen
3:45 PMBinding site sxpansion and induced fit docking for GPCR ligand binding mode prediction: Application to the b-adrenergic and chemokine receptors
Andrew Tebben, S. Roy Kimura, Percy H Carter, Qihong Zhao, Stanley R. Krystek Jr.
4:15 PMThe molecular basis of antagonist binding to CCR1: Molecular modeling and experiment
Sabine K. Schlyer, Richard Horuk, Sunil Koovakkat, Monica J. Kochanny, Rene Trabanino, William A Goddard III, Ravi Abrol, Wely B. Floriano, James Pease, James Fox, Filipa Lopez de Mendoca, Shantanu Sharma, Vaidehi Nagarajan

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The 231st ACS National Meeting, Atlanta, GA, March 26-30, 2006