Re: [gmx-users] Re: Replica exchange log file inconsistent with mdrun -replex

This should not be silent. Is there nothing in the log file that notes this is occurring? Mark On Tue, Jul 30, 2013 at 11:04 PM, Dejun Lin wrote: > OK. I found the problem is that when -replex is not a multiple of > nstcalcenergy, it'll be converted to nstcalcenergy implicitly. > > > > -- > View

[gmx-users] Re: Replica exchange log file inconsistent with mdrun -replex

OK. I found the problem is that when -replex is not a multiple of nstcalcenergy, it'll be converted to nstcalcenergy implicitly. -- View this message in context: http://gromacs.5086.x6.nabble.com/Replica-exchange-log-file-inconsistent-with-mdrun-replex-tp5010206p5010210.html Sent from the GROMA