[gmx-users] error (full of nan)

Oliver Beckstein oliver at biop.ox.ac.uk
Sat Feb 28 21:37:01 CET 2004


On Sat, 28 Feb 2004, Herbert Georg wrote:

> I think that I have discovered the problem... I'm using angstroms and
> the .gro file is in nanometers. Is this right??
> 

Yep, gromacs uses nm (and kJ/mol and ps (mostly...)). See the beginning of
the manual for units.

Oli

-- 
Oliver Beckstein * oliver at biop.ox.ac.uk
 http://sansom.biop.ox.ac.uk/oliver/




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