[phenixbb] Real-space and twin refinement

[Haim Rozenberg]

Hello,

We've just downloaded and install the new dev-1129 release of phenix hoping to be able to run RS refinement on our twin structures. According to the change log it should be possible with this version.

------------------------------------------------------------------------

Version 1.8.1 and nightly builds (TBA)
======================================

- phenix.refine:
  - overall B-cart now applied to individual atomic B-factors (restores
    pre-1.8 behavior)
  - improvements to torsion NCS rotamer correction
  - real-space refinement for twinned structures

------------------------------------------------------------------------

Unfortunately, while trying to run - through the GUI - phenix dev-1129 with our twin setting and the "Real space" option, the usual message popped up: "PHENIX error: Real-space refinement is not available for twinned structures."  FYI, it runs just fine without the "Real-space" option.

Did we have false hopes? Did we misunderstood? Is that a bug?
All the best,
Haim


============================================
Haim Rozenberg, PhD.
Department of Structural Biology
Kimmelman Building
Weizmann Institute of Science
76100 Rehovot, Israel
Phone: +972-8-9344289                  FAX:+972-8-9344136
E-Mail:  haim.rozenberg at weizmann.ac.il<mailto:haim.rozenberg at weizmann.ac.il>
============================================

    "Quis custodiet ipsos custodes?"   D.I.  Iuvenalis



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