[phenixbb] weight non-bonded contacts during rigid body refinement

Ralf W. Grosse-Kunstleve rwgk at cci.lbl.gov
Thu May 6 09:39:37 PDT 2010


Hi Kenneth,

> I wonder how I can set the weight for non-bonded contacts to zero to
> prevent clashes during rigid body refinement.

In phenix.refine the nonbonded interactions are turned off during
rigid body refinement. Currently it isn't possible to turn them on.

Ralf



More information about the phenixbb mailing list