Gräter, F.; Li, W.: Studying Functional Disulphide Bonds by Computer Simulations. In: Functional Disulphide Bonds: Methods and Protocols. Humana Press, New York (2019)

Gräter, F.; Li, W.: Transition path sampling with quantum/classical mechanics for reaction rates. In: Molecular Modeling of Proteins, pp. 27 - 45 (2015)

Seute, L.; Hartmann, E.; Stühmer, J.; Gräter, F.: Grappa – A Machine Learned Molecular Mechanics Force Field. arXiv,physics.chem-ph,2404.00050 (2024)

Richter, M.; Jin, F.; Ritterhoff, T.; Fergin, A.; Maurer, E.; Frank, A.; Hajnal, A.; Klevit, R.; Gräter, F.; Flotho, A. et al.; Melchior, F.: SUMO's intrinsically disordered N-terminus is an intramolecular inhibitor of SUMO - SIM interactions. bioRxiv (2024)