Ragnarok sdf wrote:
While trying to analyse my several windows with g_wham the following error
appears :
Fatal error:
Pull geometry direction not supported
The pull geometry "direction" has unfortunatly been forgotten in g_wham
by, well, myself (shame on me :-) ). I can add the geometry to the
g_wham code if desired. However, it is straigh-forward to make a gromacs
3 style pdo file out of your pullx files. Probably, that is a 10-liner
awk script or similar. Then, feed the pdo files into g_wham with g_wham -ip.
Best,
Jochen
--
---------------------------------------------------
Dr. Jochen Hub
Molecular Biophysics group
Dept. of Cell & Molecular Biology
Uppsala University. Box 596, 75124 Uppsala, Sweden.
Phone: +46-18-4714451 Fax: +46-18-511755
---------------------------------------------------
_______________________________________________
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
