[phenixbb] geometry weight optimization with mlhl target
pafonine at lbl.gov
Fri May 4 01:44:16 PDT 2012
I'm not sure I understand what's happening. The target weights
optimization is totally disconnected from target type, that is it should
work with any target: LS, ML, MLHL, etc.
Could you please send me all necessary inputs and explain how you run
refinement so I can reproduce this myself?
On 5/3/12 2:27 AM, Mooers, Blaine H.M. (HSC) wrote:
> Dear Phenixbb,
> How does one optimize geometry when using the mlhl target in
> refinement with Henderson-Lattman coefficients in the input reflection
> The wxc_scale keyword is not recognized when I used the mlhl target,
> but it is recognized when
> I use the ml target by setting main.use_experimental_phases=false.
More information about the phenixbb