[phenixbb] adp weighting in phenix.refine

zhangh1 at umbc.edu zhangh1 at umbc.edu
Fri Apr 1 12:18:42 PDT 2011


Hi,

In the manual of phenix.refine, it mentioned the weighting of adp term wrt
Exray:
*******************
Etotal = wxu_scale * wxu * Exray + wu * Eadp
*******************
I understand what is the geometry weighting, but for adp, could somebody
explain more about what is Eadp (or references)?

By the way, for curiosity, I want check into the source code for details.
To save some time, can somebody direct where the source code part is
located for this Eadp calculation?

Thanks!

Best Regards, Hailiang



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