GromacsTestLog

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Testing TestGromacsNotes

Gromacs Test Log

Testing Gromacs script from within VirtualBox, it's took about 8 minutes on my Macbook Pro, all tests passed.

When running on a liberated littlefe with 6 nodes, things look good until it complains: 

  not ok 8 - Running molecule w/ mdrun


Aaron, Gus, and Sam attempted this, but cluster.earlham.edu/detail no longer contains any files, so we couldn't do step 2.

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