Publications 2019 - Theoretical Biophysics

Bahrami, A., and Bahrami, A. H.: Vesicle constriction by rings of Janus nanoparticles and aggregates of curved proteins. Nanotechnology. (2019).

Chang, C., Young, L. N., Morris, K. L., Bülow, S. v., Schöneberg, J., Yamamoto-Imoto, H., Oe, Y., Yamamoto, K., Nakamura, S., Stjepanovic, G., Hummer, G., Yoshimori, T., & Hurley, J. H.: Bidirectional Control of Autophagy by BECN1 BARA Domain Dynamics. Molecular Cell, 73(2), 339-353. (2019).

Chang, Y.-N., Jaumann, E. A., Reichel, K., Hartmann, J., Oliver, D., Hummer, G., Joseph, B., and Geertsma, E. R.: Structural basis for functional interactions in dimers of SLC26 transporters. Nature Communications, 10(1), 2032. (2019).

Köfinger, J., Stelzl, L. S., Reuter, K., Allande, C., Reichel, K., and Hummer, G.: Efficient Ensemble Refinement by Reweighting. Journal of Chemical Theory and Computation. (2019).

Okazaki, K.-i., Wöhlert, D., Warnau, J., Jung, H., Yildiz, Ö., Kühlbrandt, W., & Hummer, G.: Mechanism of the electroneutral sodium/proton antiporter PaNhaP from transition-path shooting. Nature Communications, 10: 1742. (2019).

Palacio-Rodríguez, K., Lans, I., Cavasotto, C. N., & Cossio, P.: Exponential consensus ranking improves the outcome in docking and receptor ensemble docking. Scientific Reports, 9: 5142, pp. 1-14. (2019).

Perez, C., Mehdipour, A. R., Hummer, G., & Locher, K. P.: Structure of Outward-Facing PglK and Molecular Dynamics of Lipid-Linked Oligosaccharide Recognition and Translocation. Structure, 27(4). (2019).

Reuter, K., and Köfinger, J.: CADISHI: Fast parallel calculation of particle-pair distance histograms on CPUs and GPUs. Computer Physics Communications, 236, 274-284. (2019).

van Lin, S. R., Grotz, K. K., Siretanu, I., Schwierz, N., & Mugele, F.: Ion-Specific and pH-Dependent Hydration of Mica-Electrolyte Interfaces. Langmuir, 35(17), 5737-5745. (2019).

von Bülow, S., Siggel, M., Linke, M., and Hummer, G.: Dynamic cluster formation determines viscosity and diffusion in dense protein solutions. Proceedings of the National Academy of Sciences, 201817564. (2019).

von Domaros, M., Bratko, D., Kirchner, B., Hummer, G., and Luzar, A.: Multifaceted Water Dynamics in Spherical Nanocages. The Journal of Physical Chemistry C, 123(10), 5989-5998. (2019).


Max Planck Institute of Biophysics

Prof. Dr. Gerhard Hummer, Managing Director
Department of Theoretical Biophysics
Assistant to the Director: Vivian Volk

Phone: +49 (0) 69 6303-2501
E-mail: office-hummer(at)

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