[gmx-users] nanotube!

[David]

On Sun, 2005-11-06 at 19:12 +0800, 周俊红 wrote:
> 
> hi,
> 
> everyone,I am simulating carbon nanotube in water,i gain nanotube
> topol file by x2top,i use force field parameters as reference,but at
> the minimization stage,my nanotube structure was deformed,what is the
> reason? who can tell me?
Is it infinite? Then use pbc=full
> 
>  
> 
> thank you  in advance!
> 
>  
> 
>  
> 
>  
> 
>  
> 
> 
> zhoujh
> 
>                                                                          
> 
> 
> 
> 
> 
> 
> 
> 
> 
> 
> 
> ______________________________________________________________________
> 需要一个2000兆的免费邮箱吗？ 
> 网易免费邮箱是中国最多人使用的电子邮箱。 
> _______________________________________________
> gmx-users mailing list
> gmx-users at gromacs.org
> http://www.gromacs.org/mailman/listinfo/gmx-users
> Please don't post (un)subscribe requests to the list. Use the 
> www interface or send it to gmx-users-request at gromacs.org.
-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,          75124 Uppsala, Sweden
phone:  46 18 471 4205          fax: 46 18 511 755
spoel at xray.bmc.uu.se    spoel at gromacs.org   http://xray.bmc.uu.se/~spoel
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++