Advertisement

The European Physical Journal Special Topics

, Volume 224, Issue 12, pp 2173–2176 | Cite as

Scale bridging in molecular simulation

Recurrent problems and current options
  • Carsten Hartmann
  • Luigi Delle Site
Editorial
  • 395 Downloads
Part of the following topical collections:
  1. Discussion and Debate: Recurrent Problems in Scale Bridging Techniques in Molecular Simulation – What are the Current Options?

Abstract

Multiscale and multiphysics approaches have become an integral part of the molecular modeling and simulation toolbox and are used to attack various real-world problems that would be out of reach without these techniques. This special topics issue is devoted to a critical appraisal of some of the most popular scale bridging techniques for molecular simulation. It features regular articles and a “Discussion and Debate” section, in which experts in the field discuss specific articles and general aspects of scale bridging techniques.

References

  1. 1.
    The Nobel Prize in Chemistry 2013 – Press Release, Nobel Media AB 2014 (2015) http://www.nobelprize.org/nobel\_prizes/chemistry/laureates/2013/press.html
  2. 2.
    P. Tuffery, P. Derreumaux. J. R. Soc. Interface 9, 20 (2012)CrossRefGoogle Scholar
  3. 3.
    M. Guenza, Eur. Phys. J. Special Topics 224(12), 2177 (2015)CrossRefADSGoogle Scholar
  4. 4.
    J.F. Rudzinski, W.G. Noid, Eur. Phys. J. Special Topics 224(12), 2193 (2015)CrossRefADSGoogle Scholar
  5. 5.
    A. Scukins, D. Nerukh, E. Pavlov, S. Karabasov, A. Markesteijn, Eur. Phys. J. Special Topics 224(12), 2217 (2015)CrossRefADSGoogle Scholar
  6. 6.
    G. D’Adamo, R. Menichetti, A. Pelissetto, C. Pierleoni, Eur. Phys. J. Special Topics 224(12), 2239 (2015)CrossRefADSGoogle Scholar
  7. 7.
    H. Wang, A. Agarwal, Eur. Phys. J. Special Topics 224(12), 2269 (2015)CrossRefADSGoogle Scholar
  8. 8.
    K. Kreis, A.C. Fogarty, K. Kremer, R. Potestio, Eur. Phys. J. Special Topics 224(12), 2289 (2015)CrossRefADSGoogle Scholar
  9. 9.
    S. Bonella, G. Ciccotti, Eur. Phys. J. Special Topics 224(12), 2305 (2015)CrossRefADSGoogle Scholar
  10. 10.
    A. Popadić, M. Praprotnik, P. Koumoutsakos, J.H. Walther, Eur. Phys. J. Special Topics 224(12), 2321 (2015)CrossRefADSGoogle Scholar
  11. 11.
    R. Delgado-Buscalioni, J. Sablić, M. Praprotnik, Eur. Phys. J. Special Topics 224(12), 2331 (2015)CrossRefADSGoogle Scholar
  12. 12.
    R.L. Jack, P. Sollich, Eur. Phys. J. Special Topics 224(12), 2351 (2015)CrossRefADSGoogle Scholar
  13. 13.
    R. Banisch, N. Djurdjevac-Conrad, C. Schütte, Eur. Phys. J. Special Topics 224(12), 2369 (2015)CrossRefADSGoogle Scholar
  14. 14.
    S. Meloni, G. Ciccotti, Eur. Phys. J. Special Topics 224(12), 2389 (2015)CrossRefADSGoogle Scholar
  15. 15.
    P. Bolhuis, C. Dellago, Eur. Phys. J. Special Topics 224(12), 2409 (2015)CrossRefADSGoogle Scholar
  16. 16.
    T. Lelièvre, Eur. Phys. J. Special Topics 224(12), 2429 (2015)CrossRefADSGoogle Scholar
  17. 17.
    C. Schütte, M. Sarich, Eur. Phys. J. Special Topics 224(12), 2445 (2015)CrossRefADSGoogle Scholar
  18. 18.
    A. Bittracher, C. Hartmann, O. Junge, P. Koltai, Eur. Phys. J. Special Topics 224(12), 2463 (2015)CrossRefADSGoogle Scholar

Copyright information

© EDP Sciences and Springer 2015

Authors and Affiliations

  1. 1.Institut für MathematikFreie Universität BerlinBerlinGermany

Personalised recommendations