| May 15, 2007 PHYSCHEM SYMPOSIUM |
| 8:30–9:20 | | Registration/Coffee |
| 9:20–9:30 | | Welcome and Introductions, Greg Pearl & Mike Partington (ACD/Labs) |
| Key Note Lecture |
| 9:30–10:20 | | The Chemical Senses: Eye Irritation, Nasal Pungency, and Odor Detection Thresholds, Michael Abraham (University College London) |
| Session I: Enhancing pKa Predictions |
| 10:20–10:55 | | LogD and pKa Enhancements: Applications in ADME Profiling, Jordi Muñoz Muriedas (GSK) |
| 10:55–11:30 | | In Combo Approaches to Extending the Accuracy of pKa Predictions, Richard Taylor (UCB) |
| 11:30–12:15 | | Lipophilicity and Oral Drug Bioavailability, Greg Pearl (ACD/Labs) |
| 12:15–2:00 | | Lunch |
| 2:00–2:30 | | ACD/Labs PhysChem Future Plans, Greg Pearl (ACD/Labs) |
| ACD/Labs Workshop |
| 2:30–5:30 | | Improving Your ACD/Labs Software Skills, Ian Peirson & Greg Pearl (ACD/Labs) |
May 16–17, 2007 INTEGRATED ANALYTICAL AND CHROMATOGRAPHIC KNOWLEDGE MANAGEMENT SYMPOSIUM
May 16, 2007 Preliminary Workshop |
| 9:30–10:00 | | Workshop and Users' Meeting Registration |
| 10:00–11:00 | | Workshop Parallel Session 1
Workshop agendas include presentations, summary of the last release, tips and tricks, open questions, and discussions.
Topics:
Brent Lefebvre, Mark Bayliss, Michael McBrien, Colin Read (ACD/Labs) |
| 11:00–11:30 | | Break |
| 11:30–12:30 | | Workshop Parallel Session 2
Topics:
Brent Lefebvre, Mark Bayliss, Michael McBrien, Colin Read (ACD/Labs) |
| 12:30–1:30 | | Lunch |
| May 16, 2007—Users' Meeting, Day 1 |
| 1:00–1:30 | | Registration |
| 1:30–1:45 | | Welcome, Mike Partington (ACD/Labs) |
| 1:45–2:15 | | Efficient Creation of a Global Chiral Chromatographic Knowledgebase, Teresa Lints (ACD/Labs) |
| 2:15–2:45 | | AZ User Requirements for an Automated Method Development System, John Nightingale (AstraZeneca) |
| 2:45–3:15 | | Latest Advances in Chromatographic Method Development, Mike McBrien (ACD/Labs) |
| 3:15–4:00 | | Break |
| 4:00–4:30 | | Use of ACD/IntelliXtract for Metabolism Research, Lloyd King (UCB) |
| 4:30–5:00 | | Latest on ACD/Labs' MS Analysis and Interpretation, Mark Bayliss (ACD/Labs) |
| 5:00–5:30 | | Reporting of Metabolism Data, Jerome Segrestaa (Servier) |
| 5:30 | | Close of meeting for the first day |
| 7:00 | | Aperitifs |
| 8:00 | | Dinner |
| May 17, 2007—Users' Meeting, Day 2 |
| 9:00–9:30 | | Pilot to Investigate the Role of Spectral Databasing in Analytical Development, Les Hughes & Andrew Phillips (AstraZeneca) |
| 9:30–10:00 | | The Integration Conundrum of Enterprise Systems: Current Perspectives,
Mark Bayliss (ACD/Labs) |
| 10:00–10:30 | | Process Management, Colin Read (ACD/Labs) |
| 10:30–11:00 | | Break |
| 11:00–11:45 | | Turning Processes into Knowledge, Colin Read (ACD/Labs) |
| 11:45–12:15 | | Databasing of NMR Data Benefits Impurities & Degradants Research, Steve Coombes (Pfizer) |
| 12:15–12:45 | | The Cruel (Real) World of Automated Structure Verification and the Challenges that Remain to be Solved, Brent Lefebvre (ACD/Labs) |
| 12:45–2:15 | | Lunch |
| 2:15–2:45 | | Exploiting ACD/Name when Processing Small Molecule Crystal Structures for Inclusion in the Cambridge Structural Database, Ian Bruno (CCDC) |
| 2:45–3:30 | | Evolution of Chemical Databasing: ACD/ChemFolder Enterprise, Colin Read (ACD/Labs) |
| 3:30–4:00 | | Discussion/Feedback on Meeting, Mark Bayliss and Guy Desmarquets (ACD/Labs) |
| 4:00 | | End of the Users' Meeting |
