Minor tidying to mdrun.py
authorM. Eric Irrgang <ericirrgang@gmail.com>
Thu, 12 Sep 2019 07:49:47 +0000 (10:49 +0300)
committerEric Irrgang <ericirrgang@gmail.com>
Wed, 16 Oct 2019 15:07:45 +0000 (17:07 +0200)
commitb34d960808012fff1db505683b0335808774b632
tree9e233e4c591bdfccc8a26e8a6627b41a65117f98
parent1f82e445e932c902e10215fc65b7195275d30d04
Minor tidying to mdrun.py

Rearrange and annotate some code in gmxapi.simulation.mdrun prior to
functional additions.

Change-Id: If9efefce8f75681fbaa1c615d96e355a5650eedc
python_packaging/src/gmxapi/simulation/mdrun.py
python_packaging/src/test/test_mdrun.py