freeR syntax question in phenix.refine
Dear BB, Sorry for the obvious question, but I couldn't find a description of the syntax for the FreeR flag function in phenix.refine. Is there a paragraph on the phenix web site that explains what I should put in these fields: r_free_flags { file_name = "S19_sigmaa1.mtz" label = "FreeR_flag" test_flag_value = 0 --> don't know what this means? disable_suitability_test = False --> implications of this? I was running refinement from an mtz file from sigmaa in ccp4 with an appropriate FreeR flag designated in the MTZ file. phenix.refine worked fine and seemed to exclude the test reflections, but I wanted to know what these commands do. Cheers, Simon.
r_free_flags { file_name = "S19_sigmaa1.mtz" label = "FreeR_flag" test_flag_value = 0 --> don't know what this means? disable_suitability_test = False --> implications of this?
I think test flag value is the numerical value that a test set reflection has. For cns the value is usually 1 I belive (or the other way around). I tjhink some magic is carried out in order to pick the best candidate anyway. Not sure about the suitability test though. P
participants (2)
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Petrus H Zwart
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Simon Newstead