Hi everyone,
Thanks to the suggestion by Batuhan Kav, now I proceed to extract frames
from my mdcrd to restart files. I used the following command in cpptraj :
cpptraj step2.prmtop
trajin npt.mdcrd
trajout test restrt onlyframes 1
Unfortunately, there is neither restart file created in my directory, nor
could I leave cpptraj due to a warning.
There are actions/analyses/trajectories queued. Really quit? [y/n]>
I am only outputting a single frame and I did not expect that it takes so
long. My mdcrd file only contains 10 frames. Has anyone experienced this
problem before? Did I mistakenly give the wrong command?
Thanks in advance.
Regards,
Simon
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Wed Jan 24 2018 - 00:30:03 PST
