[gmx-users] pressure coupling for bilayers

[Xavier Periole]

semiisotropic is more indicated for bilayers.

  pragya chohan <pragyachohan at hotmail.com> wrote:
> 
> hi i want to rum a NPT ensemble on my bilayer+protein system. What is the 
>best pcoupletype to use. I have seen some posts on gmx user group advising 
>anisotriopic type with 
> tau_p 5.0 ps
> cpmpressibility: 4.5e-5 4.5e-5 4.5e-5 0.0  0.0 0.0
> 
> Another suggestion is welcome.
> Thanks in advance
> Pragya
> 
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-----------------------------------------------------
XAvier Periole - PhD

1- Institute of Molecular Assemblies
      City University of New York - USA
2- Molecular Dynamics-Group
      University of Groningen - The Netherlands
http://md.chem.rug.nl/~periole
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