[gmx-users] Error in NVT equilibration step
banijamali_fs
banijamali_fs at ut.ac.ir
Mon Mar 4 17:42:16 CET 2019
Hi there,
I'm doing simulation with gromacs, in NVT equilibration step when I
insert this command,
gmx grompp -f nvt_0.mdp -c min.gro -p topol.top -o nvt.tpr
I get this error:
Fatal error:
There is no domain decomposition for 48 ranks that is compatible with
the
given box and a minimum cell size of 3.33469 nm
Change the number of ranks or mdrun option -rdd or -dds
Look in the log file for details on the domain decomposition
Is there anyone who nows what should I do with this error?
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