Acoot Brett wrote:
Dear All,
For the npt.mdp downloaded from the Justin Lemkul tutorial, it seems we need to add a line of "refcoord_scaling*".* If so, its value should be "all" or "com"? I am looking forward to getting a reply from you.

Either should work. I doubt that for this case there would be a significant difference between the two.

-Justin

--
========================================

Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

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