[gmx-users] g_dipole ? => salt molecule in water => should I include counter ions in my calculation?

Chih-Ying Lin chihying2008 at gmail.com
Thu Oct 21 02:58:44 CEST 2010


HI
48.0 sum of q_i x_i
x_i is the atomic position.


For the salt molecule in water, should I include counter ions in my
calculation ?
Or, only the rest of the salt molecule except the counter ions?

Thank you
Lin
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