BioinformaticsPLOS Computational BiologyPeer-reviewed
Ensembler: Enabling high-throughput molecular simulations at the superfamily scale
Daniel L Parton, Patrick B Grinaway, Sonya M Hanson…·John D Chodera
Ensembler automates the preparation of protein structures for high-throughput molecular simulations across entire superfamilies.
DOI 10.1371/journal.pcbi.1004728