Dear all,
When running qmmm, is it possible to scale down the forces resulting
from the qm computation? Ideally i am searching for some flag (for
exxample qm-scale) such that adding qm-scale = 0.5 would scale the
forces and energies from the qm computation by half.
Thanks a lot and best regards,
Raimon
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Received on Mon Feb 19 2018 - 07:00:02 PST
