VMD-L Mailing List

From: Steven Neumann (s.neumann08_at_gmail.com)
Date: Tue Apr 23 2013 - 06:43:25 CDT

I want to write a script which makes some calculations based on specified
vectors. lets presume i want to define a variable which describes a
specific vector in my protein - e.g. C=O carobxylic group vector. What will
be the comman to return me this vector at every frame?

Steven

On Thu, Apr 18, 2013 at 5:47 PM, Axel Kohlmeyer <akohlmey_at_gmail.com> wrote:

> On Thu, Apr 18, 2013 at 5:36 PM, Steven Neumann <s.neumann08_at_gmail.com>
> wrote:
> > Dear VMD users,
> >
> > Could you pelase write me how vmd will return you vector of specified
> atom
> > or group of atoms?
>
> huh??
>
> what do you mean by this?
> what context does your question refer to?
> what vectors or groups are you talking about?
>
> axel.
>
>
> >
> > Steven
>
>
>
> --
> Dr. Axel Kohlmeyer akohlmey_at_gmail.com http://goo.gl/1wk0
> International Centre for Theoretical Physics, Trieste. Italy.
>