[phenixbb] optimize weighs

[Yusuf Akhter]

Dear all,

I am refining a protein structure using phenix.refine, when i tried to use

optimize_wxc, optimize_wxu

It always crashes and gives following error. May anybody can explain
what is the problem??




Traceback (most recent call last):
  File
"/public/xtal/phenix/phenix-1.3b/phenix-1.3b/phenix/phenix/command_line/refine.py",
line 5, in <module>
    command_line.run(command_name="phenix.refine", args=sys.argv[1:])
  File
"/public/xtal/phenix/phenix-1.3b/phenix-1.3b/phenix/phenix/refinement/command_line.py",
line 78, in run
    call_back_after_monitor_collect=call_back_after_monitor_collect)
  File
"/public/xtal/phenix/phenix-1.3b/phenix-1.3b/phenix/phenix/refinement/driver.py",
line 1308, in run
    log                     = log)
  File
"/public/xtal/phenix/phenix-1.3b/phenix-1.3b/phenix/phenix/refinement/strategies.py",
line 642, in refinement_machine
    log                           = log)
  File
"/public/xtal/phenix/phenix-1.3b/phenix-1.3b/phenix/phenix/refinement/weight_xray_chem.py",
line 327, in __init__
    self.wxc_optimization()
  File
"/public/xtal/phenix/phenix-1.3b/phenix-1.3b/phenix/phenix/refinement/weight_xray_chem.py",
line 450, in wxc_optimization
    rw, rf, b, a, a_xc = self.wx_opt_helper(w = wxc_scale_0 * wxc,
sites=True)
  File
"/public/xtal/phenix/phenix-1.3b/phenix-1.3b/phenix/phenix/refinement/weight_xray_chem.py",
line 387, in wx_opt_helper
    verbose             = 0)
TypeError: __init__() takes at least 5 non-keyword arguments (3 given)



Thanks in advance.


Yusuf
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