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Ensembler: Enabling High-Throughput Molecular Simulations at the Superfamily Scale

The rapidly expanding body of available genomic and protein structural data provides a rich resource for understanding protein dynamics with biomolecular simulation. While computational infrastructure has grown rapidly, simulations on an omics scale are not yet widespread, primarily because software...

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Detalles Bibliográficos
Autores principales: Parton, Daniel L., Grinaway, Patrick B., Hanson, Sonya M., Beauchamp, Kyle A., Chodera, John D.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Public Library of Science 2016
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4918922/
https://www.ncbi.nlm.nih.gov/pubmed/27337644
http://dx.doi.org/10.1371/journal.pcbi.1004728