Sunday:
1.00: "Welcome to our little town". Introduction to CUP
1.15: Joe Corkery: "VIDA: And now the fun begins..."
1.50: Mark McGann: "FRED grows up (a little). Gaussian Scoring Functions. PVM wrappers"
2.30: Tea Break
2.45: Anthony Nicholls: "Shape and Electrostatics I: Approximate PB methods, Perfect Charges."
3.15: Eric Manas, Wyeth-Ayerst: "Using Poisson Electrostatics in Drug Design"
3.45: Tea Break
4.00: The Levinthal Lecture: Vijay Pande, Dept. of Chemistry, Stanford University and founder of the Folding@Home project
5.00: Poster and demo set-up
6.30: Posters and demos
Michel Sanner: MSV,
Mark McGann: FRED+VIDA,
Glenn Kellogg: ZAP+Sybyl,
Joe Corkery: VIDA
John and Norah MacCuish, Mesa Analytics,
Bill Bruno, Dna Mining Informatics Software,
Daniel Pick, Syrrx,
Yvonne Martin, Abbott,
Andrew Grant, AstraZeneca,
Huw Jones, Sheffield University,
James Haigh, Sheffield University
Monday:
8.45: Video highlights of Sunday
9.00: Jonas Bostrom, AstraZeneca: "Assessing the Performance of OMEGA with Respect to Retrieving Bioactive Conformations"
9.30: Matt Stahl: "OMEGA, AESOP and other Cautionary Tales of Naming Programs"
10.00: Geoff Skillman
10.30: Tea Break
10.45: Anthony Nicholls: "Shape and Electrostatics II: The Shape Toolkit, Electro-Shape"
11.15: Dick Cramer, Tripos, "And Now for Something Completely Different: Topomers"
11.45: Round-table on Shape in Drug Design
12.15: Lunch
2.00: Roger Sayle
2.30: Carleton Sage, LION Bioscience: "Robust Measures for Feature Selection in ADME/QSPR Models"
3.00: Chris Bayly: "The AM1-BCC charging model"
3.30: OpenEye and the Conquest of Paradise: How, When and Why
4.00: Smoke 'em if you got 'em: Discussions, Demos and Dangerous Liaisons
Sessions:
7.15: Guadalajara Grill
RSVP to anthony@eyesopen.com