The point is to do it in one session of tleap automatically. I have to do
the same procedure for many systems.
On 19 September 2016 at 01:33, Bill Ross <ross.cgl.ucsf.edu> wrote:
> You can always remove the residue from a copy of the pdb in an editor,
> then loadpdb in leap.
>
> Bill
>
>
> On 9/18/16 3:46 PM, Thomas Evangelidis wrote:
> > Hello,
> >
> > is it possible to delete a residue in tleap, or create a new unit which
> > will contain everything that the old one contained apart from that
> residue,
> > without the need to use parmed?
> >
> >
> > Thomas
> >
>
>
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--
======================================================================
Thomas Evangelidis
Research Specialist
CEITEC - Central European Institute of Technology
Masaryk University
Kamenice 5/A35/1S081,
62500 Brno, Czech Republic
email: tevang.pharm.uoa.gr
tevang3.gmail.com
website: https://sites.google.com/site/thomasevangelidishomepage/
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Received on Sun Sep 18 2016 - 17:00:02 PDT
