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Journal of Chemical Theory and Computation|January 9, 2019
CoCo-MD: A Simple and Effective Method for the Enhanced Sampling of Conformational SpaceArdita Shkurti, Ioanna Danai Styliari, Vivek Balasubramanian, et al.
BMC Bioinformatics|December 23, 2018
High-throughput binding affinity calculations at extreme scalesJumana Dakka, Matteo Turilli, David W Wright, et al.
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