[gmx-users] Re: Replica exchange log file inconsistent with mdrun -replex
mark.j.abraham at gmail.com
Tue Jul 30 23:26:11 CEST 2013
This should not be silent. Is there nothing in the log file that notes
this is occurring?
On Tue, Jul 30, 2013 at 11:04 PM, Dejun Lin <dejun.lin at gmail.com> wrote:
> OK. I found the problem is that when -replex is not a multiple of
> nstcalcenergy, it'll be converted to nstcalcenergy implicitly.
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