[gmx-users] gromos43A1 force constants

David van der Spoel spoel at xray.bmc.uu.se
Fri Jun 22 09:30:29 CEST 2007


herbst at fhi-berlin.mpg.de wrote:
> Hello all!
> 
> Could someone please tell me where I can find the units of the force
> constants for bonds, angles and dihedrals for the gromos43A1 force field?
>>From the values it is clear that the units are differing from those
> usually applied in Gromacs, but I didnt see them in the manual.
> 
> Thanks a lot,
> Anna
chapter 2 in the manual.

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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://folding.bmc.uu.se
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