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Published 20 hours ago • verified publisher icon openmm

Units for "Restraining Atom Positions"

Open tonigi opened this issue 2 years ago • 0 comments

The notebook reads...

restraint.addGlobalParameter('k', 100.0*kilojoules_per_mole/nanometer)

should that be nm**2 instead? Thanks.

tonigi avatar May 05 '22 15:05 tonigi