[gmx-users] more bond in oplssaa than gromacs,why ?

[Christoph Freudenberger]

s8026264 wrote:
> Dear All
> 
> I have a molecule with 177 bond.
With or without hydrogen atoms?
> 
> 
> when I use pdb2gmx with gromacs force field, I will have 177 bond but
> 
> when I use pdb2gmx with oplssaa force field, I will have 250 bond
> 
> Why ?
oplsaa is an all atom FF.

regards
-- 
Christoph Freudenberger
Abt. Organische Chemie I AK Siehl - Uni Ulm -Tel: ++49-731-502-2785