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
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