CCPBioSim training workshop on Alchemical Free Energy Calculations with BioSimSpace

It was a pleasure for the OpenBiosim team to interact with in-person and online delegates at our BioSimSpace training workshop on Alchemical Free Energy calculations, as part of CCPBioSim‘s annual training week earlier today!

The workshop was attended by a diverse crowd of approximately 40 delegates from academia and industry in the UK and beyond. We would like to extend our gratitude to Audrius Kalpokas from the EaStCHEM School of Chemistry of the University of Edinburgh for his assistance as a demonstrator.

The introductory lecture slides are available for download here.

More importantly, all the Jupyter notebooks covered during the workshop can be accessed at This allows you to study our workshop materials at your own pace, at a time that suits you.

Written by Julien Michel.