Publikationen von Kurt Kremer

Zeitschriftenartikel (360)

61.
Zeitschriftenartikel
Fogarty, A. C.; Potestio, R.; Kremer, K.: Erratum: “Adaptive resolution simulation of a biomolecule and its hydration shell: Structural and dynamical properties” [J. Chem. Phys. 142, 195101 (2015)]. The Journal of Chemical Physics 146 (4), 049901 (2017)
62.
Zeitschriftenartikel
Guzman, H. V.; Junghans, C.; Kremer, K.; Stuehn, T.: Scalable and fast heterogeneous molecular simulation with predictive parallelization schemes. Physical Review E 96 (5), 053311 (2017)
63.
Zeitschriftenartikel
Hsu, H.-P.; Kremer, K.: Detailed analysis of Rouse mode and dynamic scattering function of highly entangled polymer melts in equilibrium. European Physical Journal - Special Topics 226 (4), S. 693 - 703 (2017)
64.
Zeitschriftenartikel
Kreis, K.; Kremer, K.; Potestio, R.; Tuckerman, M. E.: From classical to quantum and back: Hamiltonian adaptive resolution path integral, ring polymer, and centroid molecular dynamics. The Journal of Chemical Physics 147 (24), 244104 (2017)
65.
Zeitschriftenartikel
Menichetti, R.; Kanekal, K.; Kremer, K.; Bereau, T.: In silico screening of drug-membrane thermodynamics reveals linear relations between bulk partitioning and the potential of mean force. The Journal of Chemical Physics 147 (12), 125101 (2017)
66.
Zeitschriftenartikel
Mukherjee, B.; Peter, C.; Kremer, K.: Single molecule translocation in smectics illustrates the challenge for time-mapping in simulations on multiple scales. The Journal of Chemical Physics 147 (11), 114501 (2017)
67.
Zeitschriftenartikel
Mukherji, D.; Kremer, K.: How does poly(N-isopropylacrylamide) trigger phase separation in aqueous alcohol? Polymer Science, Series C 59 (1), S. 119 - 124 (2017)
68.
Zeitschriftenartikel
Mukherji, D.; Marques, C. M.; Stuehn, T.; Kremer, K.: Depleted depletion drives polymer swelling in poor solvent mixtures. Nature Communications 8, 1374 (2017)
69.
Zeitschriftenartikel
Mukherji, D.; Wagner, M.; Watson, M. D.; Winzen, S.; de Oliveira, T. E.; Marques, C. M.; Kremer, K.: Reply to the 'Comment on "Relating side chain organization of PNIPAm with its conformation in aqueous methanol''' by N. van der Vegt and F. Rodriguez-Ropero, Soft Matter, 2017, 13, DOI: 10.1039/C6SM02139E. Soft Matter 13 (12), S. 2292 - 2294 (2017)
70.
Zeitschriftenartikel
Mukherji, D.; Wagner, M.; Watson, M. D.; Winzen, S.; de Oliveira, T. E.; Marques, C. M.; Kremer, K.: Reply to the 'Comment on "Relating side chain organization of PNIPAm with its conformation in aqueous methanol''' by A. Pica and G. Graziano, Soft Matter, 2017, 13, DOI: 10.1039/C7SM01065F. Soft Matter 13 (42), S. 7701 - 7703 (2017)
71.
Zeitschriftenartikel
Ohkuma, T.; Kremer, K.: Comparison of two coarse-grained models of cis-polyisoprene with and without pressure correction. Polymer 130, S. 88 - 101 (2017)
72.
Zeitschriftenartikel
Radu, M.; Kremer, K.: Enhanced Crystal Growth in Binary Lennard-Jones Mixtures. Physical Review Letters 118 (5), 055702 (2017)
73.
Zeitschriftenartikel
Riegger, A.; Chen, C.; Zirafi, O.; Daiss, N.; Mukherji, D.; Walter, K.; Tokura, Y.; Stöckle, B.; Kremer, K.; Kirchhoff, F. et al.; Ng, D. Y. W.; Hermann, P. C.; Münch, J.; Weil, T.: Synthesis of Peptide-Functionalized Poly(bis-sulfone) Copolymers Regulating HIV-1 Entry and Cancer Stem Cell Migration. ACS Macro Letters 6 (3), S. 241 - 246 (2017)
74.
Zeitschriftenartikel
Smrek, J.; Kremer, K.: Small Activity Differences Drive Phase Separation in Active-Passive Polymer Mixtures. Physical Review Letters 118 (9), 098002 (2017)
75.
Zeitschriftenartikel
Spiegel, S.; Kremer, K.; Zifferer, G.; Olaj, O. F.: 25 Years of Macromolecular Theory and Simulations. Macromolecular Theory and Simulations 26 (1), 1600096 (2017)
76.
Zeitschriftenartikel
Bereau, T.; Andrienko, D.; Kremer, K.: Research Update: Computational materials discovery in soft matter. APL Materials 4 (5), 053101 (2016)
77.
Zeitschriftenartikel
Bereau, T.; Kremer, K.: Protein-Backbone Thermodynamics across the Membrane Interface. The Journal of Physical Chemistry B 120 (26), S. 6391 - 6400 (2016)
78.
Zeitschriftenartikel
Cortes Huerto, R.; Kremer, K.; Potestio, R.: Communication: Kirkwood-Buff integrals in the thermodynamic limit from small-sized molecular dynamics simulations. The Journal of Chemical Physics 145 (14), 141103 (2016)
79.
Zeitschriftenartikel
de Oliveira, T. E.; Netz, P. A.; Kremer, K.; Junghans, C.; Mukherji, D.: C-IBI: Targeting cumulative coordination within an iterative protocol to derive coarse-grained models of (multi-component) complex fluids. The Journal of Chemical Physics 144 (17), 174106 (2016)
80.
Zeitschriftenartikel
Fogarty, A. C.; Potestio, R.; Kremer, K.: A multi-resolution model to capture both global fluctuations of an enzyme and molecular recognition in the ligand-binding site. Proteins: Structure, Function, and Bioinformatics 84 (12), S. 1902 - 1913 (2016)
Zur Redakteursansicht