On 4/23/12 1:38 PM, Steven Neumann wrote:
Dear Gromacs Users,
My job failed on the cluster and I would like to run in from the checkpoint time
created:
mdrun -s umbrella0.tpr -cpi umbrella0.cpt -deffnm umbrella0 -pf
pullf-umbrella0.xvg -px pullx-umbrella0.xvg
Will existing files pullf-umbrella0.xvg and pullx-umbrella0.xvg be updated as
the command for the initial run is:
mdrun -s umbrella0.tpr -deffnm umbrella0 -pf pullf-umbrella0.xvg -px
pullx-umbrella0.xvg
I see no reason why they wouldn't be. Is there some problem when executing the
appending run?
-Justin
--
========================================
Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
========================================
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