Thanks Peter! Never seen this program. Will look into it. Could I ask
you questions if I have some issues.
regards,
ganesh
On Mon, Aug 23, 2010 at 1:15 PM, Peter Schmidtke
<pschmidtke.mmb.pcb.ub.es> wrote:
> Hi,
>
> try to have a look at mdpocket from the fpocket suite. This should do what you want. Have a closer look to the documentation at fpocket.sourceforge.net
>
> Regards.
>
> Peter Schmidtke
>
> -----------------
> PhD Student
> Department of Physical Chemistry
> School of Pharmacy
> University of Barcelona
> Barcelona, Spain
>
>
> On 23/08/2010, at 18:30, Ganesh Kamath wrote:
>
>> Hi All,
>>
>> Is there a way to calculate the pore volume of a protein. I have a
>> trajectory and wish to compute the volume of
>> the active site as a function of time.
>> Could anyone please suggest a way.
>>
>> thanks for all the help.
>>
>> regards,
>> ganesh
>>
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>
>
>
>
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Received on Mon Aug 23 2010 - 10:30:08 PDT
