[gmx-users] Fwd: charges,resonance and electrostatics
omermar at gmail.com
Wed Sep 24 15:36:01 CEST 2008
>> There is no non-bonded interaction between these two oxygens, unless you
>> are using an Urey-Bradley potential for the angle, like in the CHARMM force
>> field. Most (if not all) of the standard force fields in Gromacs treat the
>> interaction of these oxygens within an angle definition, which is a bonded
> So no coloumb law between the two oxygens? 10x, Omer.
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