Publikationen von Christine Peter

Zeitschriftenartikel (36)

21.
Zeitschriftenartikel
Li, C. L.; Shen, J. W.; Peter, C.; van der Vegt, N. F. A.: A Chemically Accurate Implicit-Solvent Coarse-Grained Model for Polystyrenesulfonate Solutions. Macromolecules 45 (5), S. 2551 - 2561 (2012)
22.
Zeitschriftenartikel
Mukherjee, B.; Delle Site, L.; Kremer, K.; Peter, C.: Derivation of Coarse Grained Models for Multiscale Simulation of Liquid Crystalline Phase Transitions. The Journal of Physical Chemistry B 116 (29), S. 8474 - 8484 (2012)
23.
Zeitschriftenartikel
Böckmann, M.; Marx, D.; Peter, C.; Delle Site, L.; Kremer, K.; Doltsinis, N. L.: Multiscale modelling of mesoscopic phenomena triggered by quantum events: light-driven azo-materials and beyond. Physical Chemistry Chemical Physics 13 (17), S. 7604 - 7621 (2011)
24.
Zeitschriftenartikel
Engin, O.; Villa, A.; Peter, C.; Sayar, M.: A Challenge for Peptide Coarse Graining: Transferability of Fragment-Based Models. Macromolecular Theory and Simulations 20 (7), S. 451 - 465 (2011)
25.
Zeitschriftenartikel
Rzepiela, A. J.; Louhivuori, M.; Peter, C.; Marrink, S. J.: Hybrid simulations: combining atomistic and coarse-grained force fields using virtual sites. Physical Chemistry Chemical Physics 13 (22), S. 10437 - 10448 (2011)
26.
Zeitschriftenartikel
Shen, J. W.; Li, C. L.; van der Vegt, N. F. A.; Peter, C.: Transferability of Coarse Grained Potentials: Implicit Solvent Models for Hydrated Ions. Journal of Chemical Theory and Computation 7 (6), S. 1916 - 1927 (2011)
27.
Zeitschriftenartikel
Peter, C.; Kremer, K.: Multiscale simulation of soft matter systems. Faraday Discussions 144, S. 9 - 24 (2010)
28.
Zeitschriftenartikel
Villa, A.; Peter, C.; van der Vegt, N. F. A.: Transferability of Nonbonded Interaction Potentials for Coarse-Grained Simulations: Benzene in Water. Journal of Chemical Theory and Computation 6 (8), S. 2434 - 2444 (2010)
29.
Zeitschriftenartikel
Peter, C.; Kremer, K.: Multiscale simulation of soft matter systems - from the atomistic to the coarse-grained level and back. Soft Matter 5 (22), S. 4357 - 4366 (2009)
30.
Zeitschriftenartikel
Villa, A.; Peter, C.; van der Vegt, N. F. A.: Self-assembling dipeptides: conformational sampling in solvent-free coarse-grained simulation. Physical Chemistry Chemical Physics 11 (12), S. 2077 - 2086 (2009)
31.
Zeitschriftenartikel
Villa, A.; van der Vegt, N. F. A.; Peter, C.: Self-assembling dipeptides: including solvent degrees of freedom in a coarse-grained model. Physical Chemistry Chemical Physics 11 (12), S. 2068 - 2076 (2009)
32.
Zeitschriftenartikel
Hess, B.; Peter, C.; Özal, T.; van der Vegt, N. F. A.: Fast-growth thermodynamic integration: Calculating excess chemical Potentials of additive molecules in polymer microstructures. Macromolecules 41 (6), S. 2283 - 2289 (2008)
33.
Zeitschriftenartikel
Özal, T. A.; Peter, C.; Hess, B.; van der Vegt, N. F. A.: Modeling solubilities of additives in polymer micro structures: Single-step perturbation method based on a soft-cavity reference state. Macromolecules 41 (13), S. 5055 - 5061 (2008)
34.
Zeitschriftenartikel
Peter, C.; Delle Site, L.; Kremer, K.: Classical simulations from the atomistic to the mesoscale and back: coarse graining an azobenzene liquid crystal. Soft Matter 4 (4), S. 859 - 869 (2008)
35.
Zeitschriftenartikel
Böckmann, M.; Peter, C.; Delle Site, L.; Doltsinis, N. L.; Kremer, K.; Marx, D.: Atomistic force field for azobenzene compounds adapted for QM/MM simulations with applications to liquids and liquid crystals. Journal of Chemical Theory and Computation 3 (5), S. 1789 - 1802 (2007)
36.
Zeitschriftenartikel
Peter, C.; van der Vegt, N. F. A.: Solvent reorganization contributions in solute transfer thermodynamics: Inferences from the solvent equation of state. The Journal of Physical Chemistry B 111 (27), S. 7836 - 7842 (2007)

Buchkapitel (3)

37.
Buchkapitel
Deserno, M.; Kremer, K.; Paulsen, H.; Peter, C.; Schmid, F.: Computational Studies of Biomembrane Systems: Theoretical Considerations, Simulation Models, and Applications. In: From Single Molecules to Nanoscopically Structured Materials, S. 237 - 283 (Hg. Basche, T.; Müllen, K.; Schmidt, M.). Springer International Publishing (2014)
38.
Buchkapitel
Peter, C.; Kremer, K.: Soft Matter, Fundamentals and Coarse Graining Strategies. In: Multiscale Simulation Methods in Molecular Sciences, S. 337 - 358 (Hg. Grotendorst; J.; Attig; N.; Blügel et al.). Forschungszentrum Jülich, Jülich (2009)
39.
Buchkapitel
van der Vegt, N. F. A.; Peter, C.; Kremer, K.: Structure-Based Coarse- and Fine-Graining in Soft Matter Simulations. In: Coarse-Graining of Condensed Phase and Biomolecular Systems, S. 379 - 398 (Hg. Voth, G. A.). CRC Press, Taylor and Francis Group (2008)

Meeting Abstract (5)

40.
Meeting Abstract
Chaimovich, A.; Kremer, K.; Peter, C.: Relative resolution: A hybrid strategy for molecular modeling. In Abstracts of Papers of the American Chemical Society, 249, 297. 249th National Meeting of the American-Chemical-Society (ACS), Denver, CO, 20. März 2015 - 27. März 2015. (2015)
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