[gmx-users] RE:initial configuration of ionic liquid systems

[cesar]

Luciano Costa wrote:

> Hi Roman,
>  
> I have a program that randomly add cation and anion molecules, as well 
> any molecules in a cubic box. If you want, I can send you by mail, or 
> if you want, you can visited the homepage:
>  
> http://www.ime.unicamp.br/~martinez/packmol/ 
> <http://www.ime.unicamp.br/%7Emartinez/packmol/>
>  
>
> Packmol creates an initial point for molecular dynamics simulations by 
> packing molecules in defined regions of space. The packing guarantees 
> that short range repulsive interactions do not disrupt the simulations.
>  
> Cheers,
>  
> Luciano
> -- 
> ### Luciano Tavares da Costa ###
> ##       MSc. Eng. Químico
> ##       100 % Linux
> #############################
>
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>
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-- 
Cesar Lopez Bautista
Bsc. Research assistant
Universidad Peruana Cayetano Heredia
Bioinformatics and computational Biology Unit
511 97025502
01918 at upch.edu.pe
Lima-Peru