Re: Regenerating a .dcd file

From: Axel Kohlmeyer (akohlmey_at_gmail.com)
Date: Tue Mar 09 2010 - 08:17:47 CST

On Tue, 2010-03-09 at 14:52 +0100, Ajasja Ljubetič wrote:
> Restore from a backup, perhaps? :)

come on. only wimps do backups. real men rely on
the power of magical scripts to get their data back.

;-)

axel.

> On Tue, Mar 9, 2010 at 14:27, Rabab Toubar <rtoubar_at_yahoo.com> wrote:
> Yeh, I know this is one way of doing it, bt I was thinking of
> a less time consuming method :) ... Is it possible?
>
> Rabab Toubar
>
>
> --- On Mon, 3/8/10, JC Gumbart <gumbart_at_ks.uiuc.edu> wrote:
>
> From: JC Gumbart <gumbart_at_ks.uiuc.edu>
> Subject: Re: namd-l: Regenerating a .dcd file
> To: "Rabab Toubar" <rtoubar_at_yahoo.com>
> Cc: "namd-l" <namd-l_at_ks.uiuc.edu>
> Date: Monday, March 8, 2010, 8:14 PM
>
>
>
> There is a way - run the simulation again.
>
> On Mar 8, 2010, at 2:02 PM, Rabab Toubar wrote:
>
> > Hi,
> >
> > I searched the namd mailing list for a how to
> > regenerate a .dcd file but found all posts concerned
> > with generating .coor, .vel, or .xsc
> >
> > Any suggestions on how to get the dcd file may be
> > from the same file mentioned above?
> >
> > Thanks in advance
> >
> > Rabab Toubar
> >
> >
> >
>
>
>
>

-- 
Dr. Axel Kohlmeyer  akohlmey_at_gmail.com
http://sites.google.com/site/akohlmey/
Institute for Computational Molecular Science
Temple University, Philadelphia PA, USA.

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