[gmx-users] Fatal error: 2 particles communicated to PME node 0 are more than a cell length out of the domain decomposition cell of their charge group

[wuxiao]

Dear GMXers,

   When I perfomed a MD simulation, it always teminated after about 700 ps with the message:

Fatal error: 2 particles communicated to PME node 0 are more than a cell length out of the domain decomposition cell of their charge group

   I utilized the GROMACS-4.0.5. I have searched the maillist to find some similar posts but they can not yet cope with this issues. Could you give me some clues, please?

  Best wishes,

  Chaofu Wu, Dr.
 		 	   		  
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