[gmx-users] Ions or neutral atoms?
yesint4 at yahoo.com
Fri Jul 11 08:02:01 CEST 2003
Dear gmx users,
Probably it's a stupid question, but...
If there is, say, Rb atom in the forcefield
definition, is it treated as ion ar os neutral atom?
How to see which charge is assigned to Rb and how to
force GROMACS to treat it as ion?
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