[phenixbb] Restraints on water molecules

Engin Ozkan eozkan at stanford.edu
Sun Mar 8 16:02:28 PDT 2009

Are restraints on water molecules overwritten on successive cycles of 
refinement where ordered solvent is on?  I seem to lose my distance 
restraints between specific waters and metal, unless I name my water 
molecules something else (and supply phenix with a cif for that name 
which is identical to water inside). The distance restraints also seem 
to be in effect for all cycles if ordered_solvent is off.
I am also trying to make sure water numbers don't change during solvent 


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