AMBER Archive (2003)Subject: AMBER: regarding trajectory input and output with ptraj or Carnal
From: Vlad Cojocaru (Vlad.Cojocaru_at_mpi-bpc.mpg.de)
Date: Thu Oct 02 2003 - 07:37:19 CDT
Dear ambers,
I have several dcd trajectories from NAMD. First question is: Does
Carnal support dcd input? If not I would like to transform them into
amber trajectories using ptraj, but I would like to do it in such a way
(like in Carnal) to select each 10th frame and to output the trajectory
after rms fitting to the first frame. I couldnt find in the amber manual
such an option for ptraj. Could somebody guide me just a bit into this?
Thank you very much
vlad
--
Vlad Cojocaru
Max Planck Institute for Biophysical Chemistry
Department: 060
Am Fassberg 11, 37077 Goettingen, Germany
tel: ++49-551-201.1327
e-mail: Vlad.Cojocaru_at_mpi-bpc.mpg.de
home tel: ++49-551-9963204
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber_at_scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu
|