On Thu, Jul 20, 2017, Xing wrote:
> I know that I can apply a distance restraint between two atoms
> in AMBER, can I apply a "repulsive force" restraint between the two
> atoms (or two residues) directly?
Sure: just set lower bounds but no upper bounds on the restraint. That is,
for "NMR"-type restraints, set rk3=0.
....dac
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Received on Fri Jul 21 2017 - 06:00:04 PDT
