[gmx-users] Error in energy group exclusion

bipin singh bipinelmat at gmail.com
Mon May 23 17:54:20 CEST 2011


Hello users,
I am getting the following warning during the grompp
---------------------------------------------------------------------------------
WARNING 1 [file md.mdp]:
  Can not exclude the lattice Coulomb energy between energy groups
-----------------------------------------------------------------------------------

I am providing the following energy groups and  energy exclusion group
in my mdp file
energygrps=Protein SOL
energygrp_excl=Protein Protein SOL SOL

Please suggest me, why I am getting the above error and how to get rid
of this error.


-- 
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Regards,
Bipin Singh



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