Actually I'd just like to know why both structures have such similar coloumb
energy values.
If an electro-static interaction is being made in one structure and not in the
other then their coloumb energy values should be different too, no? Wouldn't
this be visible with simple energy minimisation?
I would prefer to not do molecular dynamics, because the structure is
biologically optimal in this conformation and molecular dynamics may move it
too much.
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