[gmx-developers] How to study the influence of Lateral Pressure profile on a protein's function?

[KONG Xian]

Dear all:

         I am working on a research to study whether the Lateral pressure
profile influence the protein function.

         To get different lateral pressure profile, I used Parinello-Rahman
P coupling method and anisotropic pressure coupling with different p_ref
values(such as 0.9bar, 1bar, 1.1bar, .,2bar) in xy.

         I wonder whether this method feasible. 

If it is not feasible, could anyone please give me a hint on how to do it.
Thank you 

 

KONG Xian

Tsinghua University, Beijing, China

         

-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-developers/attachments/20110726/4c2462a3/attachment.html>