Re: Restart using amber force field

From: Sichun Yang (syang_at_physics.ucsd.edu)
Date: Fri Feb 27 2004 - 16:13:25 CST

Sorry, I made a mistake. I should not load the ambercoor into VMD at the
begining.
Thanks anyway.

Have a nice weekend.
Sichun

On Fri, 27 Feb 2004, Fangqiang Zhu wrote:

> Really? I just did a test and didn't see this problem. Are you sure you
> did specify "bincoordinates"?
>
> Zhu, Fangqiang
>
>
> Sichun Yang wrote:
>
> > Dear All,
> >
> > Sorry. I have another question about restarting the job.
> > I am using Amber force field (amber on).
> > However, when I restart my simulation, it starts from the inital structure
> > sepicified by ambercoor instead of the bincoordinates.
> > Any suggestion? Thanks for all your kind help.
> >
> > Thanks again.
> > Sichun
>
>

This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:38:27 CST