Carsten Kutzner wrote:
On Dec 21, 2009, at 5:26 PM, <david.lisgar...@canterbury.ac.uk>
<david.lisgar...@canterbury.ac.uk> wrote:
Dear Users,
Re Introductory tutorial;
Trying to run the following:
editconf -f out.gro -o fws_ctr.gro -center x/2 y/2 z/2
You have to give real coordinates for the center, not
in terms of x, y, z. The coordinates are given e.g. at
the end of the gro file.
The dimensions of the box are given at the end of the .gro file.
Mark
--
gmx-users mailing list gmx-users@gromacs.org
http://lists.gromacs.org/mailman/listinfo/gmx-users
Please search the archive at http://www.gromacs.org/search before posting!
Please don't post (un)subscribe requests to the list. Use the
www interface or send it to gmx-users-requ...@gromacs.org.
Can't post? Read http://www.gromacs.org/mailing_lists/users.php
