dc.contributor.author
Delle Site, Luigi
dc.date.accessioned
2018-06-08T11:00:54Z
dc.date.available
2018-01-25T12:35:55.413Z
dc.identifier.uri
https://refubium.fu-berlin.de/handle/fub188/21469
dc.identifier.uri
http://dx.doi.org/10.17169/refubium-24761
dc.description.abstract
In this work, we make an attempt to answer the question of what a multiscale
problem is in Molecular Dynamics (MD), or, more in general, in Molecular
Simulation (MS). By introducing the criterion of separability of scales, we
identify three major (reference) categories of multiscale problems and discuss
their corresponding computational strategies by making explicit examples of
applications. View Full-Text
en
dc.rights.uri
http://creativecommons.org/licenses/by-nc-sa/3.0/
dc.subject
multiscale modeling
dc.subject
classical atomistic
dc.subject
coarse graining
dc.subject
adaptive resolution
dc.subject.ddc
500 Naturwissenschaften und Mathematik::570 Biowissenschaften; Biologie
dc.title
What is a Multiscale Problem in Molecular Dynamics?
dc.type
Wissenschaftlicher Artikel
dcterms.bibliographicCitation
Entropy. - 16 (2014), 1, S. 23-40
dcterms.bibliographicCitation.doi
10.3390/e16010023
dcterms.bibliographicCitation.url
http://www.mdpi.com/1099-4300/16/1/23
refubium.affiliation
Biologie, Chemie, Pharmazie
de
refubium.mycore.fudocsId
FUDOCS_document_000000028876
refubium.note.author
Der Artikel wurde in einer reinen Open-Access-Zeitschrift publiziert.
refubium.resourceType.isindependentpub
no
refubium.mycore.derivateId
FUDOCS_derivate_000000009370
dcterms.accessRights.openaire
open access
