[gmx-users] gmx 2018 and external field
nedomacho at gmail.com
Sun Feb 11 08:22:21 CET 2018
I was rerunning some existing inputs and it appears that E_z is not
causing any ionic fluxes.
I am comparing two runs from identical mdp files, both with "E-z = 1
0.07 0.0" and with 2016.4 there was considerable ionic flux, as one
might expect, while with 2018 there is basically nothing. The fields are
non-negligible and the differences between the results obtained with two
GMX versions are very significant.
Did the syntax change? Any suggestions?
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