[gmx-users] Neutralising charge distribution

Georgios Patargias G.N.Patargias at leeds.ac.uk
Mon Sep 17 17:17:17 CEST 2007


Hello 

I would like to ask what is the functional form of the uniform neutralising charge 
distribution applied in Gromacs when doing PME on a charged system. 

Is there a correction term for this charge distribution that is included in the calculation 
of energies?

Thanks 
George 






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