Publications of Gerhard Hummer

Hummer, G.: Electrostatic potential of a homogeneously charged square and cube in two and three dimensions. Journal of Electrostatics 36 (3), pp. 285 - 291 (1996)

Hummer, G.; E. García, A.; Soumpasis, D. M.: A statistical mechanical description of biomolecular hydration. Faraday Discussions 103, pp. 175 - 189 (1996)

Hummer, G.; Pratt, L. R.; García, A. E.: Free Energy of Ionic Hydration. The Journal of Physical Chemistry 100 (4), pp. 1206 - 1215 (1996)

Hummer, G.; García, A. E.; Soumpasis, D. M.: Hydration of nucleic acid fragments: comparison of theory and experiment for high-resolution crystal structures of RNA, DNA, and DNA-drug complexes. Biophysical Journal 68 (5), pp. 1639 - 1652 (1995)

Hummer, G.: The numerical accuracy of truncated Ewald sums for periodic systems with long-range Coulomb interactions. Chemical Physics Letters 235 (3), pp. 297 - 302 (1995)

Hummer, G.; Pratt, L. R.; Garcia, A. E.: Hydration free energy of water. The Journal of Physical Chemistry 99 (38), pp. 14188 - 14194 (1995)

Hummer, G.; Soumpasis, D. M.: Statistical mechanical treatment of the structural hydration of biological macromolecules: Results for B-DNA. Physical Review E 50 (6), pp. 5085 - 5095 (1994)

Pratt, L. R.; Hummer, G.; Garcia´, A. E.: Ion pair potentials-of-mean-force in water. Biophysical Chemistry 51 (2), pp. 147 - 165 (1994)

Hummer, G.; Soumpasis, D. M.; Neumann, M.: Computer simulation of aqueous Na-Cl electrolytes. Journal of Physics: Condensed Matter 6 (23A), pp. A141 - A144 (1994)

Tung, C.-S.; Soumpasis, D. M.; Hummer, G.: An Extension of the Rigorous Base-unit Oriented Description of Nucleic Acid Structures. Journal of Biomolecular Structure and Dynamics 11 (6), pp. 1327 - 1344 (1994)

Hummer, G.; Soumpasis, D. M.; Neumann, M.: Computer simulations do not support Cl-Cl pairing in aqueous NaCl solution. Molecular Physics 81 (5), pp. 1155 - 1163 (1994)

Hummer, G.; Soumpasis, D. M.: Computation of the water density distribution at the ice-water interface using the potentials-of-mean-force expansion. Physical Review E 49 (1), pp. 591 - 596 (1994)

Höfers, C.; Jovin, T. M.; Hummer, G.; Arndt-Jovin, D. J.: The localization of chromosome domains in human interphase nuclei. Semi-automated two-dimensional image acquisition and analysis of fluorescence in situ hybridization signals. Bioimaging 1 (2), pp. 107 - 118 (1993)

Höfers, C.; Baumann, P.; Hummer, G.; Jovin, T. M.; Arndt-Jovin, D. J.: The localization of chromosome domains in human interphase nuclei. Three-dimensional distance determinations of fluorescence in situ hybridization signals from confocal laser scanning microscopy. Bioimaging 1 (2), pp. 96 - 106 (1993)

Hummer, G.; Soumpasis, D. M.: Correlations and free energies in restricted primitive model descriptions of electrolytes. The Journal of Chemical Physics 98 (1), pp. 581 - 591 (1993)

Hummer, G.; Soumpasis, D. M.; Neumann, M.: Pair correlations in an NaCl-SPC water model: Simulations versus extended RISM computations. Molecular Physics 77 (4), pp. 769 - 785 (1992)

Hummer, G.; Soumpasis, D. M.: An extended RISM study of simple electrolytes: pair correlations in a NaCl-SPC water model. Molecular Phylogenetics and Evolution 75 (3), pp. 633 - 651 (1992)

Köfinger, J.; Rózycki, B.; Hummer, G.: Inferring Structural Ensembles of Flexible and Dynamic Macromolecules Using Bayesian, Maximum Entropy, and Minimal-Ensemble Refinement Methods. In: Methods in Molecular Biology, Vol. 2022, pp. 341 - 352. Springer (2019)

Hummer, G.: Non-equilibrium molecular dynamics for biomolecular systems using fluctuation theorems. In: Hierarchical Methods for Dynamics in Complex Molecular Systems: IAS Winter School, 5 – 9 March 2012 Forschungszentrum Jülich GmbH Lecture Notes, pp. 269 - 279 (Ed. Grotendorst, J.). Forschungszentrum Jülich, Jülich (2012)

Hummer, G.; Szabo, A.: Thermodynamics and kinetics of single-molecule force spectroscopy. In: Theory and Evaluation of Single-molecule Signals, pp. 139 - 178 (Eds. Barkai, E.; Brown, F.; Orrit, M.; Yang, H.). World Scientific, New Jersey (2008)