[gmx-users] Length of a constrained bond

Eric Smoll ericsmoll at gmail.com
Tue Apr 17 23:04:15 CEST 2018

Hello Gromacs Users,

When setting "constraints=h-bonds" in an mdp file, what sets the
constrained bond length? Is it the equilibrium bond length in the topology,
the bond length deduced from the initial coordinates, or something else.


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