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YUP: A Molecular Simulation Program for Coarse-Grained and Multi-Scaled Models

Coarse-grained models can be very different from all-atom models and are highly varied. Each class of model is assembled very differently and some models need customized versions of the standard molecular mechanics methods. The most flexible way to meet these diverse needs is to provide access to in...

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Autors principals: Tan, Robert K.Z., Petrov, Anton S., Harvey, Stephen C.
Format: Artigo
Idioma:Inglês
Publicat: 2006
Matèries:
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC3404851/
https://ncbi.nlm.nih.gov/pubmed/22844233
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ct050323r
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