[gmx-users] Is there a setting for defualt genion selection?

Justin A. Lemkul jalemkul at vt.edu
Fri Oct 1 19:16:51 CEST 2010



TJ Mustard wrote:
> 
> 
> Hello all,
> 
>  
> 
> Is there a argument that will select SOL as the defualt selection for 
> ion substitution? I read the manual and found nothing.
> 

No, but if you're trying to incorporate this into a script or something, see:

http://www.gromacs.org/Documentation/How-tos/Making_Commands_Non-Interactive

-Justin

>  
> 
> Thank you,
> 
> TJ Mustard
> Email: mustardt at onid.orst.edu
> 

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

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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