Time | Session | Speakers |
9:00 | Open registration, coffee/tea | |
9:45 | Welcome and opening remarks | Steve St-Gallay |
Session 1 | ||
10:00 | A Scientific Smorgasbord | Paul Hawkins (OpenEye, Cadence Molecular Sciences) |
10:30 | FraGrow Frow Fragments to LLMs | Peter Ibrahim (University of Dundee) |
11:00 | Empowering scientists: delivering AI tools through an ELN framework at the enterprise level | Ting Qin and Aparna Chandrasekaran (Sygnature Discovery) |
11:30 | Macrocyclic ligand optimisation: Integrating computational approaches with biophysical data | Himani Tandon (Optibrium) |
12:00 | Lunch and poster session | |
Session 2 | ||
13:30 | Harnessing rapid transformer workflows for generative drug design | Keishi Kohara (AstraZeneca) |
14:00 | AI/ML Deployment in Orchestration in Evotec | Will Pitt (Evotec) |
14:30 | Exploration of synthesis space by application of evolutionary strategies | Emma Armstrong (University of Sheffield) |
15:00 | Break | |
Session 3 | ||
15:30 | Benchmarking 3D Structure-Based Molecule Generators | Natasha Sanjrani (GSK) |
16:00 | Open Free Energy - Open-Source Alchemy | Josh Horton (Open Free Energy) |
16:30 | Concluding remarks, poster prize winner announcement and close |
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