Aimed at: Anyone interested in learning how to use analyse_freenrg to analyse protein-ligand binding free energies, including MBAR analysis.

Requirements: Knowledge of Python, e.g. as gained from the Python for Biomolecular Modellers workshops, and ideally knowledge of free energy calculations gained from the Tackling protein alchemistry with FESetup and Sire SOMD workshop.

Abstract: Here we will explore different methods and best practices that should be employed when analysing alchemical free energy calculations for computing free energies of binding for protein and ligand complexes in an interactive python environment.