[gmx-users] force constants: GROMOS format

[David van der Spoel]

On Wed, 2004-12-01 at 14:50 +0200, Arturas wrote:
> 
> I have calculated my force constant for bond stretching and got it
> with unit kJ/(mol*nm^^2).
> 
> How to convert it to GROMOS96 FF ??? :
> 
> kJ/(mol*nm^^2) --> kJ/(mol*nm^^4)
> 
see manual

> 
> Thanks in advance
> Arturas
> 
> 
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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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