[gmx-users] Problems with grompp

[Christoph Freudenberger]

Dallas Warren wrote:
>>             Last week I did the same calculation and everything went 
>> fine. Can someone guess what is happening ? ..
> 
> 
> Something happened to the ff###.atp file on the machine you are running 
> it on, you are running it on a different machine which has a different 
> ff###.atp file, or you are selecting a different ff### in the .top file.

My guess would be for ff###nb.itp, but definitly one of the force field
files got screwed up.

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