Ensembler: Enabling high-throughput molecular simulations at the superfamily scale
Daniel L Parton, Patrick B Grinaway, Sonya M Hanson, Kyle A Beauchamp, John D Chodera
Ensembler automates the preparation of protein structures for high-throughput molecular simulations across entire superfamilies.
PLOS Computational Biology · Jun 23, 2016Peer-reviewedBioinformatics