Details of the performed MD simulations.
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https://figshare.com/articles/dataset/_Details_of_the_performed_MD_simulations_/505984
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资源简介：
Molecular dynamics simulations were performed using ACEMD [36], [37], a new generation of molecular dynamics software which performs all the calculations on graphical processing units (GPUs) instead of standard CPUs, as well as GPUGRID.net (http://www.gpugrid.net) a globally distributed volunteer computing project [38], [39] harnessing the power of graphics cards for computation all around the globe (see Supporting Information for further details).
创建时间：
2010-08-12
