[gmx-users] constraint distance
tsjerkw at gmail.com
Mon Sep 11 12:19:46 CEST 2006
The only way to get away with that is to merge your two parts to form
one molecule, with the only connection being a distance_restraint (or
another bonded term if you want to emulate bond-like behaviour such as
On 9/11/06, kanin wichapong <kwichapong at gmail.com> wrote:
> Dear All
> I would like to know how to constraint the distance between the
> different molecule, ex. the ligand and the protein. As far as I know
> whatever to do the constraint, distance, angle dihedral, it can do just in
> the same molecule.
> Thank you in advance for all of your help.
> With Best all regard,
> gmx-users mailing list gmx-users at gromacs.org
> Please don't post (un)subscribe requests to the list. Use the
> www interface or send it to gmx-users-request at gromacs.org.
> Can't post? Read
Tsjerk A. Wassenaar, M.Sc.
Groningen Biomolecular Sciences and Biotechnology Institute (GBB)
Dept. of Biophysical Chemistry
University of Groningen
9747AG Groningen, The Netherlands
+31 50 363 4336
More information about the gromacs.org_gmx-users