[gmx-users] intermolecular distance restraint

warren deng warrendnj at gmail.com
Tue Apr 14 06:24:49 CEST 2009

Hi Gromacs users,

In my simulation, I need to restrain distances between atoms on two protein
molecules. But the Gromacs manual on NOE seems to imply that the atom
indices belong to the same molecule type.

So I am wondering whether it is possible to create distance restraint
between two molecule types in Gromacs?

Many thanks,

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