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Unbiased, scalable sampling of protein loop conformations from probabilistic priors

BACKGROUND: Protein loops are flexible structures that are intimately tied to function, but understanding loop motion and generating loop conformation ensembles remain significant computational challenges. Discrete search techniques scale poorly to large loops, optimization and molecular dynamics te...

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Autors principals: Zhang, Yajia, Hauser, Kris
Format: Artigo
Idioma:Inglês
Publicat: BioMed Central 2013
Matèries:
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC3953323/
https://ncbi.nlm.nih.gov/pubmed/24565175
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/1472-6807-13-S1-S9
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