Thank you!!!! For your rapidly responce!!!!
Anthony
On Wednesday 26 September 2007 11:44 am, Carlos Simmerling wrote:
> try using iwrap=1
>
> On 9/26/07, Anthony Cruz <acb15885.uprm.edu> wrote:
> > Hi User:
> > I have been wotking with a simulation of a heme protein in water. I
> > decide to
> > run the simulation in multiple steeps of 500 ps. Right now I have 116
> > part
> > of 500ps (aprox. 60 ns). The problem is that when I re-start the
> > simulation
> > to do other 5ns of simulation the simulation stop because one of the
> > parts cant read the box or the restart file from the previous part. When
> > I check the file I found the some of the coordinate were written as *. I
> > restart all
> > the parts again and have the same problem again. How I can resolve the
> > problem of the coordinates in the restart file???
> >
> > Best regards,
> > Anthony
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Received on Sun Sep 30 2007 - 06:07:13 PDT
