AMBER: question about ntx=5

From: Wei Chen <>
Date: Sun, 25 Nov 2007 14:21:44 -0500

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?


Wei Chen

The AMBER Mail Reflector
To post, send mail to
To unsubscribe, send "unsubscribe amber" to
Received on Wed Nov 28 2007 - 06:07:07 PST
Custom Search