Hi all,
I restart my simulation with ntx=5, reading in coordinates and velocities.
This is a non-periodic simulation, ntb=0. I also set nscm=0 because I do not
want to remove the velocity of center of mass. But I found that the velocity
of center of mass was removed at first restart step. How can I avoid this?
Thanks,
Wei Chen
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Wed Nov 28 2007 - 06:07:07 PST