Re: [AMBER] error in crd file due to lack of disk space

From: David A Case <>
Date: Thu, 29 Dec 2011 10:36:11 -0500

On Thu, Dec 29, 2011, Ashutosh Shandilya wrote:
> *
> *After running MD simulation for 10ns it got stopped because of lack of
> disk space (I suppose) so it could not write the final inpcrd file so I am
> unable to restart the job. Although I have the topology and trajectory
> file. Is there anyway that I can get the coordinates and velocity after
> defined time scale. *

Unfortunately, no. It is likely that you will need to re-run that portion of
the simulation.


AMBER mailing list
Received on Thu Dec 29 2011 - 08:00:03 PST
Custom Search