[gmx-users] Fatal error: Atomtype 'IW' not found!
David
spoel at xray.bmc.uu.se
Tue Mar 23 21:11:00 CET 2004
On Tue, 2004-03-23 at 19:00, Bamidele Adisa wrote:
> Hi,
>
> I'm trying to run grompp using oplsaa with tip4 water model but i'm getting
> the following error:
> "Fatal error: Atomtype 'IW' not found!"
Replace FF_OPLS by _FF_OPLS in tip4p.itp
>
> could you pls help me out here?
> thanks in advance.
> dele
>
> ______________________
> Bamidele Adisa
> Dept of Chemical Engineering
> Clemson University
> Clemson, SC 29634-0909
> 864-654-0586
> ______________________
>
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--
David.
________________________________________________________________________
David van der Spoel, PhD, Assist. 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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