Multiscale simulation of soft matter systems
- PMID: 20158020
- DOI: 10.1039/b919800h
Multiscale simulation of soft matter systems
Abstract
This paper gives a short introduction to multiscale simulation approaches in soft matter science. This paper is based on and extended from a previous review. (1. C. Peter and K. Kremer, Soft Matter, 2009, DOI:10.1039/b912027k.) It also includes a discussion of aspects of soft matter in general and a short account of one of the historically underlying concepts, namely renormalization group theory. Some different concepts and several typical problems are shortly addressed, including a (more personal) view on challenges and chances.
Similar articles
-
Multiscale modeling of soft matter: scaling of dynamics.Phys Chem Chem Phys. 2011 Jun 14;13(22):10412-20. doi: 10.1039/c1cp20247b. Epub 2011 Apr 5. Phys Chem Chem Phys. 2011. PMID: 21468407
-
Multiscale simulation of soft matter: from scale bridging to adaptive resolution.Annu Rev Phys Chem. 2008;59:545-71. doi: 10.1146/annurev.physchem.59.032607.093707. Annu Rev Phys Chem. 2008. PMID: 18062769 Review.
-
The physics of open systems for the simulation of complex molecular environments in soft matter.Soft Matter. 2019 Mar 6;15(10):2114-2124. doi: 10.1039/c8sm02523a. Soft Matter. 2019. PMID: 30761396
-
Mesoscopic modelling and simulation of soft matter.Soft Matter. 2017 Dec 20;14(1):9-26. doi: 10.1039/c7sm01711a. Soft Matter. 2017. PMID: 29211098
-
Coarse-grained modeling for macromolecular chemistry.Top Curr Chem. 2012;307:295-321. doi: 10.1007/128_2010_122. Top Curr Chem. 2012. PMID: 21360319 Review.
Cited by
-
Pathways and challenges towards a complete characterization of microgels.Nat Commun. 2020 Sep 4;11(1):4315. doi: 10.1038/s41467-020-17774-5. Nat Commun. 2020. PMID: 32887886 Free PMC article. Review.
-
Chilling alcohol on the computer: isothermal compressibility and the formation of hydrogen-bond clusters in liquid propan-1-ol.Eur Phys J E Soft Matter. 2023 Nov 29;46(11):117. doi: 10.1140/epje/s10189-023-00380-w. Eur Phys J E Soft Matter. 2023. PMID: 38019330 Free PMC article.
-
Classical electrostatics for biomolecular simulations.Chem Rev. 2014 Jan 8;114(1):779-814. doi: 10.1021/cr300461d. Epub 2013 Aug 27. Chem Rev. 2014. PMID: 23981057 Free PMC article. Review. No abstract available.
-
Oligomer/Polymer Blend Phase Diagram and Surface Concentration Profiles for Squalane/Polybutadiene: Experimental Measurements and Predictions from SAFT-γ Mie and Molecular Dynamics Simulations.Macromolecules. 2020 Apr 14;53(7):2299-2309. doi: 10.1021/acs.macromol.9b02155. Epub 2020 Apr 3. Macromolecules. 2020. PMID: 32308214 Free PMC article.
-
Protocol for the development of coarse-grained structures for macromolecular simulation using GROMACS.PLoS One. 2023 Aug 3;18(8):e0288264. doi: 10.1371/journal.pone.0288264. eCollection 2023. PLoS One. 2023. PMID: 37535543 Free PMC article.
LinkOut - more resources
Full Text Sources