[gmx-users] Re: Sorry for interrupt you.This mail include the *.itp files
David van der Spoel
spoel at xray.bmc.uu.se
Thu Apr 24 14:40:01 CEST 2003
On Thu, 2003-04-24 at 14:27, PeiQuan Chen wrote:
> Dear David:
> Here is my files that I use to make a CCl4 box!
> Can you have a check with my files, and give me hints.
try setting rvdw switch to 0
vdwtype = cutoff
>
> Thank you very much?
> 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
> ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
--
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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