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technical:recipes:gromacs-plumed [2024-05-12 14:52] – [Compilation and Installation: Plumed-patched Gromacs] bkang | technical:recipes:gromacs-plumed [2024-05-12 15:03] (current) – [Scaling] bkang | ||
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===== Scaling ===== | ===== Scaling ===== | ||
- | This is the wall time for the structure relaxation | + | This is the wall time for MD run of 41057 atom, and nsteps=10000 |
- | {{: | + | {{: |