On Tue, May 26, 2015, Dan Roe wrote:
>
> My interpretation of this is that when irest=1 the time is whatever is
> in the restart file, otherwise it is whatever is specified by 't', or
> zero if not specified. However in both sander and pmemd this is
> currently not the case. The initial time is always taken from the
> restart file; even when irest=0 and 't' is specified, the value of 't'
> is overwritten by the one from the restart.
I think this should be fixed, and agree with Dan's arguments about why.
....dac
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Received on Tue May 26 2015 - 09:00:03 PDT
