Gerhard Hummer

Chemical Physics NIH (NIDDK) 
"Gerhard Hummer"
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Pietrek LM, Stelzl LS, Hummer G. (2019) Hierarchical Ensembles of Intrinsically Disordered Proteins at Atomic Resolution in Molecular Dynamics Simulations. Journal of Chemical Theory and Computation
Heinz M, Erlenbach N, Stelzl LS, et al. (2019) High-resolution EPR distance measurements on RNA and DNA with the non-covalent $\acute{\rm G}$ spin label. Nucleic Acids Research
Linker SM, Magarkar A, Köfinger J, et al. (2019) Fragment Binding Pose Predictions Using Unbiased Simulations and Markov-State Models. Journal of Chemical Theory and Computation
Köfinger J, Różycki B, Hummer G. (2019) Inferring Structural Ensembles of Flexible and Dynamic Macromolecules Using Bayesian, Maximum Entropy, and Minimal-Ensemble Refinement Methods. Methods in Molecular Biology (Clifton, N.J.). 2022: 341-352
Vögele M, Köfinger J, Hummer G. (2019) Finite-Size-Corrected Rotational Diffusion Coefficients of Membrane Proteins and Carbon Nanotubes from Molecular Dynamics Simulations. The Journal of Physical Chemistry. B
Koefinger J, Stelzl LS, Reuter K, et al. (2019) Efficient Ensemble Refinement by Reweighting. Journal of Chemical Theory and Computation
Chang C, Young LN, Morris KL, et al. (2018) Bidirectional Control of Autophagy by BECN1 BARA Domain Dynamics. Molecular Cell
Schöneberg J, Pavlin MR, Yan S, et al. (2018) ATP-dependent force generation and membrane scission by ESCRT-III and Vps4. Science (New York, N.Y.). 362: 1423-1428
Grotz K, Nüesch M, Holmstrom E, et al. (2018) Dispersion Correction Alleviates Dye Stacking of Single-Stranded DNA and RNA in Simulations of Single-Molecule Fluorescence Experiments. The Journal of Physical Chemistry. B
Reichel K, Stelzl LS, Köfinger J, et al. (2018) Precision DEER Distances from Spin-Label Ensemble Refinement. The Journal of Physical Chemistry Letters. 5748-5752
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