[gmx-users] Structure file for di atmoic molecule

Justin Lemkul jalemkul at vt.edu
Sun Mar 31 18:24:56 CEST 2013



On 3/31/13 12:23 PM, Juliette N. wrote:
> Dear gmx users,
>
> Does anyone know how to obtain structure file for the simple ethylene
> molecule ( C-C) ? I tried PRODRG but it fails to generate structure files
> for di atomic molecules.
>
> Any suggestion is appreciated!
>

For something as simple as a diatomic molecule, open up your favorite text 
editor and write it by hand :)

-Justin

-- 
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Justin A. Lemkul, Ph.D.
Research Scientist
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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