Dialogues in the Midst: Evaluating Drug Binding in Protein Variants Using Free Energy Perturbation

Contribution List

1. Registration

3/28/25, 9:00 AM

12. Fundamentals of Free Energy Perturbation (FEP)

Dr Tandac Furkan Guclu (Sabanci University)

3/28/25, 9:30 AM

13. Preparing and running the FEP simulations

Dr Tandac Furkan Guclu (Sabanci University)

3/28/25, 11:00 AM

14. Thermodynamic cycles, mutation energies, and relative binding energies

Dr Tandac Furkan Guclu (Sabanci University)

3/28/25, 1:30 PM

15. Analysis of FEP simulations

Dr Tandac Furkan Guclu (Sabanci University)

3/28/25, 2:30 PM