[gmx-users] couple several systems

[Florian Haberl]

Hi,

On Wednesday 04 January 2006 08:52, Rongliang Wu wrote:
> Hello gmx-users,
>
> 	since coupling just several atoms will cause significant fluctuations of
> temperature for those atoms, i'd like to couple NA with SOL together, will
> it be possible by modifying the mdp file? or should i make an index file?
> and how to make that?

use make_ndx

choose than your groups combine them to a new group and than add this new 
group name to your mdp file

>
> Thanks!
>
> Regards!
>
> Sincerely,
>
> Rongliang Wu
> State Key Laboratory
> of Polymer Physics and Chemistry
> Center of Molecular Science
> Institute of Chemistry
> Chinese Academy of Sciences
>
>
> 　　　　　　　　　　wurl04 at iccas.ac.cn
> 　　　　　　　　　　2006-01-04

Greetings,

Florian

-- 
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 Florian Haberl                        
 Computer-Chemie-Centrum   
 Universitaet Erlangen/ Nuernberg
 Naegelsbachstr 25
 D-91052 Erlangen
 Mailto: florian.haberl AT chemie.uni-erlangen.de
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