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Rule-based spatial modeling with diffusing, geometrically constrained molecules

BACKGROUND: We suggest a new type of modeling approach for the coarse grained, particle-based spatial simulation of combinatorially complex chemical reaction systems. In our approach molecules possess a location in the reactor as well as an orientation and geometry, while the reactions are carried o...

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Autors principals: Gruenert, Gerd, Ibrahim, Bashar, Lenser, Thorsten, Lohel, Maiko, Hinze, Thomas, Dittrich, Peter
Format: Artigo
Idioma:Inglês
Publicat: BioMed Central 2010
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Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC2911456/
https://ncbi.nlm.nih.gov/pubmed/20529264
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/1471-2105-11-307
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