Wednesday, 7 June 2006: 8:30 AM-9:35 AM
Cocoa 5 (Hershey Lodge and Convention Center)
Computers in Chemistry (COMP)
Computers in Chemistry
This oral session features contributed papers in the area of Computers in Chemistry.
Sponsor: ACS Division of Computers in Chemistry
Organizer:Nichols Murgolo
Presider:Nichols Murgolo
8:30 AMIntroductory Remarks
8:35 AMFragment based prediction of hERG binding
Matthew Clark, Minghu Song
8:55 AMArtificial intelligent molecular dynamics and Hamiltonian surgery
Les Woodcock, John F. Maguire
9:15 AMWeb-based computational laboratory
Norah MacCuish

Back to The 38th Middle Atlantic Regional Meeting (June 4-7, 2006)