[gmx-users] How to obtain structures with large RMSD?

Liu, Liang liu4gre at gmail.com
Mon Oct 10 17:04:30 CEST 2011

Hi, all,

I am trying to use Gromacs to obtain structural ensembles around native
structures (PDB structures).
However the simulated structures are always very close to the initial one,
with RMSD < 0.2.
I am wondering how to obtain large-RMSD structures? Thanks.

Liang Liu
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