[gmx-users] problem with energy minimization

Mark Abraham Mark.Abraham at anu.edu.au
Tue Jan 31 06:12:59 CET 2012


On 31/01/2012 4:10 PM, Anushree Tripathi wrote:
> When I run the command (i.e., mdrun -v -deffnm em) for energy 
> minimization.
>
> I am getting the error:
>
> There is no domain decomposition for 4 nodes that is compatible with 
> the given box and a minimum cell size of 4.07513 nm.

See 
http://www.gromacs.org/Documentation/errors#There_is_no_domain_decomposition_for_n_nodes_that_is_compatible_with_the_given_box_and_a_minimum_cell_size_of_x_nm

Mark
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