[gmx-users] Problem in energy minimization and domain decomposition
Sadaf Rani
sadafrani6 at gmail.com
Tue Feb 18 21:58:12 CET 2020
Dear Gromacs users
I am getting the following message while running an energy minimization:-
There is no domain decomposition for 32 ranks that is compatible with the
given box and a minimum cell size of 1.85723 nm
I am not using any distance restraint, and selecting box size by the
following command :
gmx editconf -f rescloselig.gro -o rescloseligbox.gro -bt cubic -d 1.2
Can you please suggest me how should I fix it.
Thanks.
Sadaf
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