[gmx-users] to find out number of solvent molecules within certain radius of the protein

[shivangi nangia]

Hi,

Where can I find the documentation for g_select?

Thanks,
SN



On Tue, Jul 26, 2011 at 6:07 PM, Justin A. Lemkul <jalemkul at vt.edu> wrote:

>
>
> shivangi nangia wrote:
>
>> Dear gmx-users,
>>
>> I wish to calculate the number of solvent molecules within certain radius
>> of the protein all through the trajectory.
>>
>> Is there any utility available with gromacs to do so?
>>
>>
> Dynamic selections can be made with g_select.
>
> -Justin
>
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> Justin A. Lemkul
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