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Development of Coarse-Grained Models for Polymers by Trajectory Matching

[Image: see text] Coarse-grained (CG) models allow for simulating the necessary time and length scales relevant to polymers. However, developing realistic force fields at the CG level is still a challenge because there is no guarantee that the CG model reproduces all the properties of the atomistic...

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Publicat a:ACS Omega
Autors principals: Kempfer, Kévin, Devémy, Julien, Dequidt, Alain, Couty, Marc, Malfreyt, Patrice
Format: Artigo
Idioma:Inglês
Publicat: American Chemical Society 2019
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC6648800/
https://ncbi.nlm.nih.gov/pubmed/31459746
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acsomega.9b00144
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