[gmx-users] script to add water in protein

pooja_gupta at nccs.res.in pooja_gupta at nccs.res.in
Mon Aug 12 09:43:42 CEST 2013


Thanks

I am looking for code (python, C++), not gromacs command line.

pooja


> http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin/gmx-tutorials/lysozyme/03_solvate.html
>
>
> On Mon, Aug 12, 2013 at 4:09 PM, <pooja_gupta at nccs.res.in> wrote:
>
>> Hi
>>
>> I want to add water molecule in my structure. Do anyone have idea how to
>> add water molecules in protein structure. I little aware of python.
>> How the gromacs spc216 add the water molecule. Can i get the code for
>> the
>> same?
>>
>> pooja
>>
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