I checked the files again and the mdinfo file showed a time 'earlier' than the mdout file . I think it is a normal condition and I can safely continue my task .
Thanks !
At 2011-08-04 10:31:04,"Jason Swails" <jason.swails.gmail.com> wrote:
>If the mdinfo file showed a time *later* than the mdout file, then this is
>unexpected. However, pmemd uses a different flushing interval for the mdout >and mdinfo files (that is, output is flushed to the mdout file at least >every 30 seconds, whereas the mdinfo is flushed every 60 seconds). This is >done for performance reasons, but also shows that the mdinfo file may show >different information than the mdout file.> >HTH,>Jason> >On Wed, Aug 3, 2011 at 9:26 PM, zhouhaibin2008.ok <zhouhaibin2008.ok.163.com >> wrote:>>> Hi all, >> I used sander to run MD production , but for some reason the task was >> stopped . When I wanted to restart the task , I found that the sander output >> file and restart file showed the same time to show when the task was stopped >> ,but the mdinfo file showed a different time . I wanted to known if the >> three files should show the same time . Did the different time mean some >> errors had happened ? >> Thank you in advance! >> _______________________________________________ >> AMBER mailing list >> AMBER.ambermd.org >> http://lists.ambermd.org/mailm
an/listinfo/amber>>>> >>-- >Jason M. Swails >Quantum Theory Project,>University of Florida >Ph.D. Candidate>352-392-4032 >_______________________________________________ >AMBER mailing list >AMBER.ambermd.org >
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Received on Wed Aug 03 2011 - 20:00:03 PDT
