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Entries: 1-10  
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Rheology of Ring Polymer Melts: From Linear Contaminants to Ring-Linear Blends
Authors: Halverson, J. D.; Grest, G. S.; Grosberg, A. Y.; Kremer, Kurt
Date of Publication (YYYY-MM-DD): 2012
Title of Journal: Physical Review Letters
Volume: 108
Issue / Number: 3
Sequence Number of Article: 038301
Document Type: Article
ID: 580596.0
Structure Formation of Toluene around C60: Implementation of the Adaptive Resolution Scheme (AdResS) into GROMACS
Authors: Fritsch, S.; Junghans, C.; Kremer, Kurt
Date of Publication (YYYY-MM-DD): 2012
Title of Journal: Journal of Chemical Theory and Computation
Volume: 8
Issue / Number: 2
Start Page: 398
End Page: 403
Document Type: Article
ID: 584275.0
Kirkwood-Buff Analysis of Liquid Mixtures in an Open Boundary Simulation
Authors: Mukherji, D.; van der Vegt, Nico F. A.; Kremer, Kurt; Delle Site, Luigi
Date of Publication (YYYY-MM-DD): 2012
Title of Journal: Journal of Chemical Theory and Computation
Volume: 8
Issue / Number: 2
Start Page: 375
End Page: 379
Document Type: Article
ID: 584276.0
Multiscale Simulation of Small Peptides: Consistent Conformational Sampling in Atomistic and Coarse-Grained Models
Authors: Bezkorovaynaya, O.; Lukyanov, A.; Kremer, Kurt; Peter, Christine
Date of Publication (YYYY-MM-DD): 2012
Title of Journal: Journal of Computational Chemistry
Volume: 33
Issue / Number: 9
Start Page: 937
End Page: 949
Document Type: Article
ID: 605639.0
Adaptive resolution molecular dynamics simulation through coupling to an internal particle reservoir
Authors: Fritsch, S.; Poblete, S.; Junghans, C.; Ciccotti, G.; Delle Site, Luigi; Kremer, Kurt
Date of Publication (YYYY-MM-DD): 2012
Title of Journal: Physical Review Letters
Volume: 108
Issue / Number: 17
Sequence Number of Article: 170602
Document Type: Article
ID: 610015.0
Simulations of nematic homopolymer melts using particle-based models with interactions expressed through collective variables
Authors: Daoulas, Kostas C.; Rühle, V.; Kremer, Kurt
Date of Publication (YYYY-MM-DD): 2012
Title of Journal: Journal of Physics-Condensed Matter
Volume: 24
Issue / Number: 28
Sequence Number of Article: 284121
Document Type: Article
ID: 611783.0
Derivation of Coarse Grained Models for Multiscale Simulation of Liquid Crystalline Phase Transitions
Authors: Mukherjee, B.; Delle Site, Luigi; Kremer, Kurt; Peter, Christine
Date of Publication (YYYY-MM-DD): 2012
Title of Journal: Journal of Physical Chemistry B
Volume: 116
Issue / Number: 29
Start Page: 8474
End Page: 8484
Document Type: Article
ID: 614830.0
Structure-based coarse-graining in liquid slabs
Authors: Jochum, M.; Andrienko, Denis; Kremer, Kurt; Peter, Christine
Date of Publication (YYYY-MM-DD): 2012
Title of Journal: Journal of Chemical Physics
Volume: 137
Issue / Number: 6
Sequence Number of Article: 064102
Document Type: Article
ID: 626136.0
Preferential Solvation of Triglycine in Aqueous Urea: An Open Boundary Simulation Approach
Authors: Mukherji, D.; van der Vegt, Nico F. A.; Kremer, Kurt
Date of Publication (YYYY-MM-DD): 2012
Title of Journal: Journal of Chemical Theory and Computation
Volume: 8
Issue / Number: 10
Start Page: 3536
End Page: 3541
Document Type: Article
ID: 627508.0
Temperature and Pressure Dependence of Polystyrene Dynamics through Molecular Dynamics Simulations and Experiments
Authors: Harmandaris, V. A.; Floudas, G.; Kremer, Kurt
Date of Publication (YYYY-MM-DD): 2011
Title of Journal: Macromolecules
Volume: 44
Issue / Number: 2
Start Page: 393
End Page: 402
Document Type: Article
ID: 550877.0
Entries: 1-10  
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