Do you mean constrain the force constants just in the z-direction? Keep in
mind that the water is already in the gap, so it's now a matter of getting
it out. Would constraining water in any direction accomplish this?
Thanks,
Max
On Nov 19 2007, himanshu khandelia wrote:
I already constrained the waters in the z-direction
at the start of the simulation, so that didn't work in this case.
This happened to me as well. Try increasing the force constants on
water by an order of magnitude.
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