[gmx-users] Re: Question abouttau_p value!

David van der Spoel spoel at xray.bmc.uu.se
Tue Apr 22 15:04:01 CEST 2003


On Tue, 2003-04-22 at 14:48, PeiQuan Chen wrote:
> Dear David:
>   
> >Your cut-off is too close to half the box length and scaling makes the
> >box smaller than twice the cut-off
>   Thank you for your kindly reply.  
>   Do you mean that I should set the cut-off value smaller?
>   And Which value should I define for cut-off?
>   

you don't give any number on cut-off or box size.

all I can say is cut-off < half the box.

>   Thank you in advance!!
>    
> Sincerely yours
> ---- 
> PeiQuan Chen
> ________________________________________________________________________
> PeiQuan Chen 	Department of Chemistry, Nankai University
> WeiJin Road 94, TianJin, 300071, P.R.China
> phone:	(86)2223506728		Mobile Phone: (+86)13920675030
> gromacs at 163.com	
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> 
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-- 
Groeten, David.
________________________________________________________________________
Dr. David van der Spoel, 	Dept. of Cell & Mol. Biology
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
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