[gmx-users] Fw: question:Justin toturial

André Farias de Moura moura at ufscar.br
Tue Feb 2 00:57:31 CET 2016


same generic answers as for your previous non-answered message.

and BTW: does it make any sense to say that a protein has a
compressibility? do you really think that you could partition the system
compressibility into a sum of compressibilities arising from individual
components? check the mechanical/thermodynamical definition of
compressibility before going in that direction...

On Mon, Feb 1, 2016 at 9:02 PM, Mass <masstransfer_2010 at yahoo.com> wrote:

> Hi team,Any comments on this?
>
>      On Thursday, January 28, 2016 12:19 PM, Mass <
> masstransfer_2010 at yahoo.com> wrote:
>
>
>
>
>
> Good afternoon gmx user,
> How to calculate protein compressibility in Gromacs? I have a 20 ns
> protein in water simulation (Justin toturial Lysozyme) and want to
> calculate the compressibility of protein.
>
> Greetings
>
> Mass
>
>
>
>
>
>
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-- 
_____________

Prof. Dr. André Farias de Moura
Department of Chemistry
Federal University of São Carlos
São Carlos - Brazil
phone: +55-16-3351-8090


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