The next meeting of the Cambridge Cheminformatics Network will be on 8th June 2022 and will be a hybrid meeting, with Zoom and in-person attendees.
4pm-6pm BST
Wednesday 8th June 2022
Zoom - link on organiser's website here.
In-person: CCDC office, 12 Union Road, Cambridge, CB2 1EZ, UK.
Agenda:
- Programme Efficient algorithms for fingerprint similarity search and diversity selection - Andrew Dalke, Dalke Scientific
- Chemical substructure and similarity search at scale on a Graph computing platform - Andrew Stolman, Katana Graph
- Automated determination of optimal λ schedules for free energy calculations - Sofia Bariami and Marc Mackey, Cresset
To attend on Zoom, register on the organiser's website here.
To attend in person, contact Andreas Bender on andreas (at) drugdiscovery.net
