[gmx-users] Re: Warning when using both LJ and Buckingham non-bonded interaction

[David van der Spoel]

WU Yanbin wrote:
> Hi, Everybody,
>   And I found that if this simulation is on gromacs3.3, the warning 
> becomes error.
>                                                                Yours 
> Sincerely,
>     

indeed, since this is not implemented. you canhowever use table 
potentials that differe between interaction pairs.

-- 
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://folding.bmc.uu.se
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