[gmx-users] gromacs doubt

[Mark Abraham]

On 8/05/2010 8:40 PM, manjula kasinathan wrote:
> hi all
>
>        i'm doing simulation for complex structure (protein length around
> 1020). while running mdrun for position restrain it shows error like this
>
>
>
> Step 434, time 0.868 (ps)  LINCS WARNING

See 
http://www.gromacs.org/index.php?title=Documentation/Errors&highlight=errors#LINCS.2fSETTLE.2fSHAKE_warnings

Mark