MPIP Publications

Search results

Journal Article (34)

  1. 1.
    Journal Article
    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)
  2. 2.
    Journal Article
    Delle Site, L.; Deserno, M.; Dünweg, B.; Holm, C.; Peter, C.; Pleiner, H.: Modern simulation approaches in soft matter science: From fundamental understanding to industrial applications. European Physical Journal - Special Topics 225 (8-9), pp. 1317 - 1321 (2016)
  3. 3.
    Journal Article
    Krishnamani, V.; Globisch, C.; Peter, C.; Deserno, M.: Breaking a virus: Identifying molecular level failure modes of a viral capsid by multiscale modeling. European Physical Journal - Special Topics 225 (8-9), pp. 1757 - 1774 (2016)
  4. 4.
    Journal Article
    Xiao, S.; Peter, C.; Kremer, K.: Systematic comparison of model polymer nanocomposite mechanics. Bioinspiration & Biomimetics 11 (5), 055008 (2016)
  5. 5.
    Journal Article
    Chaimovich, A.; Peter, C.; Kremer, K.: Relative resolution: A hybrid formalism for fluid mixtures. The Journal of Chemical Physics 143 (24), 243107 (2015)
  6. 6.
    Journal Article
    Debnath, A.; Wiegand, S.; Paulsen, H.; Kremer, K.; Peter, C.: Derivation of coarse-grained simulation models of chlorophyll molecules in lipid bilayers for applications in light harvesting systems. Physical Chemistry Chemical Physics 17 (34), pp. 22054 - 22063 (2015)
  7. 7.
    Journal Article
    Kahlen, J.; Peter, C.; Donadio, D.: Molecular simulation of oligo-glutamates in a calcium-rich aqueous solution: insights into peptide-induced polymorph selection. CrystEngComm 17 (36), pp. 6863 - 6867 (2015)
  8. 8.
    Journal Article
    Jain, A.; Jochum, M.; Peter, C.: Molecular Dynamics Simulations of Peptides at the Air-Water Interface: Influencing Factors on Peptide-Templated Mineralization. Langmuir 30 (51), pp. 15486 - 15495 (2014)
  9. 9.
    Journal Article
    Kahlen, J.; Salimi, L.; Sulpizi, M.; Peter, C.; Donadio, D.: Interaction of Charged Amino-Acid Side Chains with Ions: An Optimization Strategy for Classical Force Fields. Journal of Physical Chemistry B 118 (14), pp. 3960 - 3972 (2014)
  10. 10.
    Journal Article
    Potestio, R.; Peter, C.; Kremer, K.: Computer Simulations of Soft Matter: Linking the Scales. Entropy 16 (8), pp. 4199 - 4245 (2014)
  11. 11.
    Journal Article
    Schach, D.; Globisch, C.; Roeters, S. J.; Woutersen, S.; Fuchs, A.; Weiss, C. K.; Backus, E. H. G.; Landfester, K.; Bonn, M.; Peter, C. et al.; Weidner, T.: Sticky water surfaces: Helix-coil transitions suppressed in a cell-penetrating peptide at the air-water interface. The Journal of Chemical Physics 141 (22), 22D517 (2014)
  12. 12.
    Journal Article
    Dalgicdir, C.; Sensoy, O.; Peter, C.; Sayar, M.: A transferable coarse-grained model for diphenylalanine: How to represent an environment driven conformational transition. The Journal of Chemical Physics 139 (23), 234115 (2013)
  13. 13.
    Journal Article
    Globisch, C.; Krishnamani, V.; Deserno, M.; Peter, C.: Optimization of an Elastic Network Augmented Coarse Grained Model to Study CCMV Capsid Deformation. PLoS One 8 (4), e60582 (2013)
  14. 14.
    Journal Article
    Mukherjee, B.; Peter, C.; Kremer, K.: Dual translocation pathways in smectic liquid crystals facilitated by molecular flexibility. Physical review E 88 (1), 010502 (2013)
  15. 15.
    Journal Article
    Shen, J.-W.; Li, C. L.; van der Vegt, N. F. A.; Peter, C.: Understanding the Control of Mineralization by Polyelectrolyte Additives: Simulation of Preferential Binding to Calcite Surfaces. Journal of Physical Chemistry C 117 (13), pp. 6904 - 6913 (2013)
  16. 16.
    Journal Article
    Bereau, T.; Globisch, C.; Deserno, M.; Peter, C.: Coarse-Grained and Atomistic Simulations of the Salt-Stable Cowpea Chlorotic Mottle Virus (SS-CCMV) Subunit 26-49: beta-Barrel Stability of the Hexamer and Pentamer Geometries. Journal of Chemical Theory and Computation 8 (10), pp. 3750 - 3758 (2012)
  17. 17.
    Journal Article
    Bezkorovaynaya, O.; Lukyanov, A.; Kremer, K.; Peter, C.: Multiscale Simulation of Small Peptides: Consistent Conformational Sampling in Atomistic and Coarse-Grained Models. Journal of Computational Chemistry 33 (9), pp. 937 - 949 (2012)
  18. 18.
    Journal Article
    Jochum, M.; Andrienko, D.; Kremer, K.; Peter, C.: Structure-based coarse-graining in liquid slabs. The Journal of Chemical Physics 137 (6), 064102 (2012)
  19. 19.
    Journal Article
    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), pp. 2551 - 2561 (2012)
  20. 20.
    Journal Article
    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), pp. 8474 - 8484 (2012)
 
loading content
Go to Editor View