Publications of Kurt Kremer
All genres
Journal Article (368)
41.
Journal Article
52 (14), pp. 5307 - 5316 (2019)
Backbone Chemical Composition and Monomer Sequence Effects on Phenylene Polymer Persistence Lengths. Macromolecules 42.
Journal Article
52 (3), pp. 968 - 981 (2019)
Generic Model for Lamellar Self-Assembly in Conjugated Polymers: Linking Mesoscopic Morphology and Charge Transport in P3HT. Macromolecules 43.
Journal Article
238, pp. 66 - 76 (2019)
ESPResSo++ 2.0: Advanced methods for multiscale molecular simulation. Computer Physics Communications 44.
Journal Article
151 (14), 144105 (2019)
Steering a solute between coexisting solvation states: Revisiting nonequilibrium work relations and the calculation of free energy differences. The Journal of Chemical Physics 45.
Journal Article
150 (9), 091101 (2019)
A coarse-grained polymer model for studying the glass transition. The Journal of Chemical Physics 46.
Journal Article
150 (15), 159902 (2019)
Erratum: A coarse-grained polymer model for studying the glass transition [J. Chem. Phys. 150, 091101 (2019)]. The Journal of Chemical Physics 47.
Journal Article
21 (5), pp. 196 - 197 (2019)
Van't Hoff prize for Mischa Bonn. Bunsen-Magazin 48.
Journal Article
52 (9), pp. 3471 - 3478 (2019)
Soft and Smart: Co-nonsolvency-Based Design of Multiresponsive Copolymers. Macromolecules 49.
Journal Article
8 (2), pp. 155 - 160 (2019)
Threading of Unconcatenated Ring Polymers at High Concentrations: Double-Folded vs Time-Equilibrated Structures. ACS Macro Letters 50.
Journal Article
151 (24), 244110 (2019)
Direct route to reproducing pair distribution functions with coarse-grained models via transformed atomistic cross correlations. The Journal of Chemical Physics 51.
Journal Article
15 (2), pp. 289 - 302 (2019)
Hierarchical modelling of polystyrene melts: from soft blobs to atomistic resolution. Soft Matter 52.
Journal Article
41 (5), 64 (2018)
Concurrent coupling of realistic and ideal models of liquids and solids in Hamiltonian adaptive resolution simulations. European Physical Journal E 53.
Journal Article
14 (7), pp. 3409 - 3417 (2018)
Spatially Resolved Thermodynamic Integration: An Efficient Method To Compute Chemical Potentials of Dense Fluids. Journal of Chemical Theory and Computation 54.
Journal Article
20 (4), 222 (2018)
Fluctuations, Finite-Size Effects and the Thermodynamic Limit in Computer Simulations: Revisiting the Spatial Block Analysis Method. Entropy 55.
Journal Article
116 (21-22), pp. 3301 - 3310 (2018)
Finite-size integral equations in the theory of liquids and the thermodynamic limit in computer simulations. Molecular Physics 56.
Journal Article
7 (1), pp. 107 - 111 (2018)
Primitive Path Analysis and Stress Distribution in Highly Strained Macromolecules. ACS Macro Letters 57.
Journal Article
121 (16), 167801 (2018)
Chain Retraction in Highly Entangled Stretched Polymer Melts. Physical Review Letters 58.
Journal Article
1 (7), 1800024 (2018)
Polymorphism of Syndiotactic Polystyrene Crystals from Multiscale Simulations. Advanced theory and simulations 59.
Journal Article
498 (2), pp. 282 - 287 (2018)
Efficient potential of mean force calculation from multiscale simulations: Solute insertion in a lipid membrane. Biochemical and Biophysical Research Communications 60.
Journal Article
57 (39), pp. 12626 - 12648 (2018)
Engineering Proteins at Interfaces: From Complementary Characterization to Material Surfaces with Designed Functions. Angewandte Chemie International Edition