[gmx-users] units

David spoel at xray.bmc.uu.se
Fri Aug 23 20:49:42 CEST 2002


On Fri, 2002-08-23 at 18:43, Pedro Alexandre Lapido Loureiro wrote:
> Hello,
> 
> according to the manual (p. 93) the bond stretching potentials of ffgmx* and
> ffG43* are respectively: kJ/mol.nm**2 and kJ/mol.nm**4. Is that right?
> But the values written in the ff*bon.itp files (looking at correspondent bonds)
> show another relation.
> Am I missing something?
Yes, but it's in the manual chapter 4.
> 
> Cheers,
> 
> Pedro.
> 
> --
> Pedro Alexandre Lapido Loureiro
> Laboratório de Física Biológica
> Instituto de Biofísica
> UFRJ
> Brasil 
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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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