[gmx-users] Lennard-Jones parameters for manganese

[Lieven Buts]

Lieven Buts wrote:
> The potential functions are plotted in red (MM3-
> derived) and green (ffgmxnb.itp). The curves are
> very similar. The minimum energy is slighly higher
> for the MM3-derived values.

Make that "the minimum energy is slightly *lower*
for the MM3-derived values". Sorry.

--
Lieven Buts
Department of Ultrastructure