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Metadynamic metainference: Enhanced sampling of the metainference ensemble using metadynamics
Accurate and precise structural ensembles of proteins and macromolecular complexes can be obtained with metainference, a recently proposed Bayesian inference method that integrates experimental information with prior knowledge and deals with all sources of errors in the data as well as with sample h...
Autores principales: | Bonomi, Massimiliano, Camilloni, Carlo, Vendruscolo, Michele |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Nature Publishing Group
2016
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4999896/ https://www.ncbi.nlm.nih.gov/pubmed/27561930 http://dx.doi.org/10.1038/srep31232 |
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