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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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Detalles Bibliográficos
Autores principales: Zhang, Yajia, Hauser, Kris
Formato: Online Artículo Texto
Lenguaje:English
Publicado: BioMed Central 2013
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3953323/
https://www.ncbi.nlm.nih.gov/pubmed/24565175
http://dx.doi.org/10.1186/1472-6807-13-S1-S9