[gmx-users] How can i use a Morse potential bond stretching in Gromacs

David van der Spoel spoel at xray.bmc.uu.se
Tue Aug 13 15:17:24 CEST 2002


On Tue, 2002-08-13 at 14:23, Bernd Rupp wrote:
> Hi,
> 
> I have a parameter list  for Bondstretching, but these Parameters are for a 
> morsepotential.
> How can i use this Parameters in Gromacs?
> 
> I think it should be an other func typein the bond topologie but i cant see 
> which one it could be.
I think it is three.

check the printed manual. 
> 
> Thanks for help
> -- 
> Bernd Rupp
> 
> 
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-- 
Groeten, David.
________________________________________________________________________
Dr. David van der Spoel, 	Biomedical center, Dept. of Biochemistry
Husargatan 3, Box 576,  	75123 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://zorn.bmc.uu.se/~spoel
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