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CCDC > Cambridge Cheminformatics Network February 2025

Cambridge Cheminformatics Network February 2025

Date of Event

19 February 2025

Wednesday, 19th of February 2025, 16:00-17:30 (GMT)

This meeting will be held in person at the CCDC office in Cambridge and via Zoom. As usual, followed by a social at the Panton Arms and an ‘Online Worldwide Cheminformatics Pub Night’!

More details and registration here.

Talks for this session;

Identifying Novel Nanomolar A2A Receptor Ligands by Combining Docking and Reinforcement Learning (Morgan Thomas, Universitat Pompeu Fabra)
Reversible Molecular Simulation for Training Classical and Machine Learning Force Fields (Joe Greener, LMB)
A Whirlwind Tour of Gaussian Processes for Chemistry (Austin Tripp, Valence Labs)