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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Bibliographic Details
Main Authors: Daniel L Parton, Patrick B Grinaway, Sonya M Hanson, Kyle A Beauchamp, John D Chodera
Format: Article
Language:English
Published: Public Library of Science (PLoS) 2016-06-01
Series:PLoS Computational Biology
Online Access:http://europepmc.org/articles/PMC4918922?pdf=render