dear Ross and Jason
Thank you for correction
It is my fault, I forget to set ntwe and offcourse I didn't set -e mden, so
I never see .mden file.
sorry to bother you all.
setyanto
On Mon, Aug 2, 2010 at 11:52 PM, Bill Ross <ross.cgl.ucsf.edu> wrote:
> trj and mden are different files - see docs for how to print mden.
>
> Bill
>
> > Should I extract the information from mdout using *.trj file ?
> >
> > On Mon, Aug 2, 2010 at 12:24 PM, Bill Ross <ross.cgl.ucsf.edu> wrote:
> >
> > > This could be a good time to learn awk or perl, to write simple
> > > programs to process text files. You may also want to look at the
> > > mden file
>
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Received on Mon Aug 02 2010 - 20:30:04 PDT
