Webinar - Protein FEP: Free Energy Perturbation on Protein Residues with the Schrödinger Platform

September 12, 2019

Time: 1:00 PM EDT 
Speaker: Dr. Guido Scarabelli

In recent years, the Schrödinger Free Energy Perturbation tool (FEP+) has been used to accurately predict the relative binding free energy for small molecule – protein complexes by mutating ligand atoms. The same technique can be applied to protein structures to determine the effect of residue side-chain mutations on binding affinity and on protein thermal stability. This webinar will show how to prepare, launch, and analyze Protein FEP calculations as well as presenting results obtained on protein binding affinity and thermal stability. 
 

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