|
|||||||||||||||||||||||||||||||||
AMBER Archive (2001)Subject: Re: why the slowdown?
From: Bill Ross (ross_at_cgl.ucsf.edu)
Could someone provide an explanation as to why I'm seeing
The 2nd should run faster because the temp restraints
Is there a problem with the input parameters or is it something else?
It looks like you might have cold-started the 2nd run by irest=0?
Also, can you check cpu usage to see if all the cpu's are actually
Bill Ross
| |||||||||||||||||||||||||||||||||
|