[gmx-users] How do i continue mdrun!

T.A.Wassenaar T.A.Wassenaar at rug.nl
Sat Jun 18 08:38:50 CEST 2005

Hi Chiloo,

Check the mailing list! This question has been posted only 
a few days ago. The answer is

tpbconv -s md.tpr -f md.trr -e md.edr -o md2.tpr



On Fri, 17 Jun 2005 18:11:51 -0700 (PDT)
  chiloo Laohpongspaisan <chiloo77 at yahoo.com> wrote:
> Dear All,
> I've run md for several days, and the job was killed.
> How can i continue mdrun in the next step (the step 
>after the job was stopped).
> my command at first time is following:
> mdrun -s md.tpr -o md.trr -c pmd.gro -g md.log -e md.edr 
> Best regard,
> chiloo
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