[gmx-users] Relaxed frozen groups

[Justin A. Lemkul]

Zack Scholl wrote:
> Hi all-
> 
> Is it possible to freeze a group of atoms only partially in a
> direction?  For instance, could I freeze a group inside a box of a
> definite size?
> 
> 

Not by defining a box, as such, but you can freeze any subset of atoms with a 
suitable index file that defines the desired freezegrps.

-Justin

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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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