[gmx-users] grompp warning - serious or not?

[David van der Spoel]

On Tue, 2005-03-01 at 10:57 +0000, Samantha Kaye wrote:
> Hi,
> I have been getting this warning when running grompp in gromacs 3.2.1 
> and using the ffG53a6 forcefield:
> WARNING 2 [file "1S50_protein.itp", line 9698]:
>   No default G96Angle types, using zeroes
> Excluding 3 bonded neighbours for Protein 1
> Excluding 3 bonded neighbours for GLT 1
> Excluding 1 bonded neighbours for HOH 359
> Excluding 2 bonded neighbours for SOL 24471
> 
> Is this a serious problem or should I ignore it?
Yes. Fix it.
> TIA
> Sam
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-- 
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
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