遇见数据集

Project files provided as supporting information to the manuscript "Coarse-grained Mori-Zwanzig dynamics in a time-non-local stationary-action framework"

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Project files provided as supporting information to the manuscript "Coarse-grained Mori-Zwanzig dynamics in a time-non-local stationary-action framework" GLE Optimization: Optimizator of GLE parameters. Uses Matlab MD_GLE: CG GLE and LE simulator. Uses Matlab Water_simulation: Folders for atomistic water system simulation with GROMACS. It requires to be run on Linux with GROMACS and VOTCA packages installed.

创建时间:
2022-02-22
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