Publikationen von Kurt Kremer
Alle Typen
Zeitschriftenartikel (367)
Zeitschriftenartikel
118 (9), 098002 (2017)
Small Activity Differences Drive Phase Separation in Active-Passive Polymer Mixtures. Physical Review Letters
Zeitschriftenartikel
26 (1), 1600096 (2017)
25 Years of Macromolecular Theory and Simulations. Macromolecular Theory and Simulations
Zeitschriftenartikel
4 (5), 053101 (2016)
Research Update: Computational materials discovery in soft matter. APL Materials
Zeitschriftenartikel
120 (26), S. 6391 - 6400 (2016)
Protein-Backbone Thermodynamics across the Membrane Interface. The Journal of Physical Chemistry B
Zeitschriftenartikel
145 (14), 141103 (2016)
Communication: Kirkwood-Buff integrals in the thermodynamic limit from small-sized molecular dynamics simulations. The Journal of Chemical Physics
Zeitschriftenartikel
144 (17), 174106 (2016)
C-IBI: Targeting cumulative coordination within an iterative protocol to derive coarse-grained models of (multi-component) complex fluids. The Journal of Chemical Physics
Zeitschriftenartikel
84 (12), S. 1902 - 1913 (2016)
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
Zeitschriftenartikel
145 (18), 184901 (2016)
Maier-Saupe model of polymer nematics: Comparing free energies calculated with Self Consistent Field theory and Monte Carlo simulations. The Journal of Chemical Physics
Zeitschriftenartikel
144 (15), 154907 (2016)
Static and dynamic properties of large polymer melts in equilibrium. The Journal of Chemical Physics
Zeitschriftenartikel
12 (8), S. 4067 - 4081 (2016)
Adaptive Resolution Simulations with Self-Adjusting High-Resolution Regions. Journal of Chemical Theory and Computation
Zeitschriftenartikel
12 (7), S. 3030 - 3039 (2016)
From Classical to Quantum and Back: A Hamiltonian Scheme for Adaptive Multiresolution Classical/Path-Integral Simulations. Journal of Chemical Theory and Computation
Zeitschriftenartikel
12 (38), S. 7995 - 8003 (2016)
Relating side chain organization of PNIPAm with its conformation in aqueous methanol. Soft Matter
Zeitschriftenartikel
145 (23), 234101 (2016)
Adaptive resolution simulation of oligonucleotides. The Journal of Chemical Physics
Zeitschriftenartikel
144 (5), 051102 (2016)
Communication: Consistent interpretation of molecular simulation kinetics using Markov state models biased with external information. The Journal of Chemical Physics
Zeitschriftenartikel
11 (5), 055008 (2016)
Systematic comparison of model polymer nanocomposite mechanics. Bioinspiration & Biomimetics
Zeitschriftenartikel
11 (6), S. 2783 - 2791 (2015)
Automated Parametrization of the Coarse-Grained Martini Force Field for Small Organic Molecules. Journal of Chemical Theory and Computation
Zeitschriftenartikel
143 (24), 243107 (2015)
Relative resolution: A hybrid formalism for fluid mixtures. The Journal of Chemical Physics
Zeitschriftenartikel
11 (44), S. 8599 - 8604 (2015)
Why does high pressure destroy co-non-solvency of PNIPAm in aqueous methanol? Soft Matter
Zeitschriftenartikel
17 (34), S. 22054 - 22063 (2015)
Derivation of coarse-grained simulation models of chlorophyll molecules in lipid bilayers for applications in light harvesting systems. Physical Chemistry Chemical Physics
Zeitschriftenartikel
142 (6 ), 064115 (2015)
Statistical mechanics of Hamiltonian adaptive resolution simulations. The Journal of Chemical Physics