Presentation Archives
2009
| Presentation | Venue |
|---|---|
| Conformer generation: Identifying and learning from failures [PDF 5.3 MB]Paul Hawkins | ACS |
| Sampling of conformational space in the PDB: Why would I worry? [PDF 5.3 MB]Paul Hawkins | ACS |
| Conformation dependent partial charges and why a dialectric is your friend [PDF 7.5 MB]Anthony Nicholls | CUP X |
| Why is Quantum Mechanics not more useful? [717 KB]Tom Darden | CUP X |
| OEChem Meets OpenMP [709 KB]Brian Cole | CUP X |
| MDL Query and Reaction Support in OEChem [508 KB]Krisztina Boda | CUP X |
2008
| Presentation | Venue |
|---|---|
| Validation with the RCSB: Good idea or bad idea? [PDF 80 KB ]Paul Hawkins |
Computer-Aided Drug Design Keystone Symposium |
| Validation with the RCSB: Good idea or bad idea? [PDF 80 KB ]Paul Hawkins |
Computer-Aided Drug Design Keystone Symposium |
| MCSS IN OEChem [609 KB]Krisztina Boda | CUP IX |
| Zap 2 [348 KB]Ben Ellingson | CUP IX |
| Grids and Surfaces [855 KB]Brian Cole | CUP IX |
| Scripting in VIDA [256 KB]Joe Corkery | CUP IX |
| Mathematics, Shape Space and Other Marriages Made in Heaven [760 KB]Paul Hawkins | CUP IX |
| Field of Extremes: If You Re-refine It, They Will Come [1.2 MB]Greg Warren, OpenEye & Manuel Perola, Vertex | CUP IX |
| SAMPL1 at First Glance [1 MB]Geoff Skillman | CUP IX |
| 2D Control: Emulating the Algorithms Inside Chemists' Heads [1 MB]Roger Sayle | CUP IX |
2007
| Presentation | Venue |
|---|---|
| Introduction and General Complaints[PDF] Anthony Nicholls | CUP VIII |
| The Shiraz Challenge: Predicting IL2 and IL4 inhibitors[PDF] Greg Warren & Geoff Skillman | CUP VIII |
| The GSK-Warren et al docking data set, "Fred versus Greg"[PDF] Mark McGann | CUP VIII |
| Bioisostere Prediction and Application[PDF] Geoff Skillman | CUP VIII |
| OE Product Revue: Lexichem, and OEToolkits (OEChem, etc.)[PDF] [PDF] OE Staff | CUP VIII |
| Slow Train Coming. EON Pulls into the Station[PDF] Bob Tolbert | CUP VIII |
| Dielectric Theory. Who Knew It'd Be This Easy[PDF] Anthony Nicholls | CUP VIII |