Hi Sindrilla,
The main issue here is that the velocities are not stored in a mdcrd trajectory.
This has been covered fairly extensively on the Amber mailing list. For example, see: http://archive.ambermd.org/201303/0057.html
All the best,
Ben Madej
Walker Molecular Dynamics Lab
On Mar 18, 2013, at 11:25 PM, Sindrila Dutta banik <sindrila.duttabanik.yahoo.com> wrote:
> Dear all,
> I have a trajectory file. Now I want to save a particular snapshot from the trajectory and then use this as a input file for the further calculation. How can i same a particular frame from the trajectory. plz let me know.
> with best regards
> sindrila
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Received on Tue Mar 19 2013 - 11:00:02 PDT
