Past Events
This CCP-BioSim training workshop will introduce non-specialists to the use of free energy methods for modelling protein-ligand interactions and computing free energies of binding. It is aimed at postgraduate students and early-stage career researchers. The molecular simulation program ProtoMS (http://www.protoms.org) will be used.
Workshop Material
The workshop material can be found here
Instructors
Julien Michel (Edinburgh), Christopher Woods (Bristol), Michael Bodnarchuk (Southampton), Samuel Genheden (Southampton)
Reference
- Prediction of protein-ligand binding affinity by free energy simulations: assumptions, pitfalls and expectations, Michel, J. ; Essex, J. W. J. Comput. Aided Mol. Des., 24 (8), 639 -658 2010 http://dx.doi.org/10.1007/s10822-010-9363-3
Venue
School of Chemistry, University of Southampton
Registration
Register at https://eventbooking.stfc.ac.uk/news-events/free-energy-methods-for-modelling-of-protein-ligand-interactions
Space available: 35 delegates
Fee Info: Registration is free for this event. Lunch will be provided.
Accommodation not available.
For further information contact Meeting Administrator (