On Tue, Feb 01, 2005, Brandon Tefft wrote:
> Can someone please explain how I can
> add an external electric field or attach a force to a
> group of atoms in Amber?
You will have to do some programming yourself. The easiest thing is probably
to modify the xconst() function (in ene.f) to change harmonic forces on
a given group of atoms into the forces that would be arising from the external
field.
.....good luck..dac
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Received on Wed Feb 02 2005 - 18:53:00 PST
