Hello:
I'm trying to run a simulation that crashes with the message below.
At this point, I'm not a the level of being able to interpret the
error so, I'm uncertain whether is caused by an ill-conditioned model
( input ) or an actual bug in the code.
I would enormously appreciate if someone can give me a hands with this.
Sincerely,
Baudilio
-------------------------------------------------------
Program mdrun_mpi_d, VERSION 4.0.5
Source code file: domdec.c, line: 2592
Fatal error:
The X-size of the box (9.999306) times the triclinic skew factor
(1.000000) is smaller than the number of DD cells (4) times the
smallest allowed cell size (2.500000)
-------------------------------------------------------
_______________________________________________
gmx-users mailing list gmx-users@gromacs.org
http://lists.gromacs.org/mailman/listinfo/gmx-users
Please search the archive at http://www.gromacs.org/search before posting!
Please don't post (un)subscribe requests to the list. Use the
www interface or send it to gmx-users-requ...@gromacs.org.
Can't post? Read http://www.gromacs.org/mailing_lists/users.php
