2021

Benayad Z, von Bülow S, Stelzl LS and Hummer G (2021) Simulation of FUS protein condensates with an adapted coarse-grained model. J Chem Theory Comput, 17:525–537 Link

2020

Pietrek LM, Stelzl LS and Hummer G (2020) Hierarchical ensembles of intrinsically disordered proteins at atomic resolution in molecular dynamics simulations. J Chem Theory Comput, 16:725–737 Link

Stelzl LS, Mavridou DA, Saridakis E, Gonzalez D, Baldwin AJ, Ferguson SJ, Sansom MS and Redfield C (2020) Local frustration determines loop opening during the catalytic cycle of an oxidoreductase. eLife, 9:e54661 Link

2017

Stelzl LS, Erlenbach N, Heinz M, Prisner TF and Hummer G (2017) Resolving the conformational dynamics of DNA with Ångstrom resolution by pulsed electron–electron double resonance and molecular dynamics. J Am Chem Soc, 139:11674–11677 Link

Stelzl LS and Hummer G (2017) Kinetics from Replica Exchange Molecular Dynamics Simulations. J Chem Theory Comput, 13:3927–3935 Link

Stelzl LS, Kells A, Rosta E and Hummer G (2017) Dynamic histogram analysis to determine free energies and rates from biased simulations. J Chem Theory Comput, 13:6328–6342 Link