[gmx-users] too much warnings and notes
mailmd2011 at gmail.com
Mon Oct 29 15:57:13 CET 2012
On 10/29/2012 03:56 PM, Carsten Kutzner wrote:
> find the reason for the warnings in your mdp file settings
> and adjust them accordingly.
> You can also override the warnings with the -maxwarn <number>
> option in grompp.
thanks for kind reply.
the only thing I confused is the last one:
NOTE 4 [file md.mdp]:
The sum of the two largest charge group radii (0.597592) is larger than
rlist (1.000000) - rvdw (1.200000)
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