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Hello,
I am trying to backmap a CG structure to an all-atom representation (Amber03).
When I run initram.sh, I get the following error:
ERROR 1 [file 1-EM.mdp]: Energy group exclusions are currently not supported
I think group cutoff is deprecated in the latest GROMACS, so I am not sure what to do. Any help would be greatly appreciated
Thank you! :-)
The text was updated successfully, but these errors were encountered:
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Hello,
I am trying to backmap a CG structure to an all-atom representation (Amber03).
When I run initram.sh, I get the following error:
I think group cutoff is deprecated in the latest GROMACS, so I am not sure what to do. Any help would be greatly appreciated
Thank you! :-)
The text was updated successfully, but these errors were encountered: