Phenix: Difference between revisions

3 bytes added ,  29 July 2019
Line 416: Line 416:
* run your model through TLSMD server to identify TLS domains (it will produce PHENIX friendly TLS groups selections);
* run your model through TLSMD server to identify TLS domains (it will produce PHENIX friendly TLS groups selections);
http://skuld.bmsc.washington.edu/~tlsmd/
http://skuld.bmsc.washington.edu/~tlsmd/
* or use <code>phenix.find_tls_groups</code> to find TLS groups, and to generate a tls_selections.def file.
* use these selections for TLS refinement in PHENIX: see http://www.phenix-online.org/documentation/reference/refinement.html
* use these selections for TLS refinement in PHENIX: see http://www.phenix-online.org/documentation/reference/refinement.html


Line 431: Line 432:


Alternatively, phenix.refine can identify TLS groups on-the-fly, using <pre>tls.find_automatically=True</pre>
Alternatively, phenix.refine can identify TLS groups on-the-fly, using <pre>tls.find_automatically=True</pre>
* phenix.find_tls_groups now can find TLS groups automatically, and generate a tls_selections.def file.


At lower resolution than 1.5A if you run two consecutive refinements, first with TLS  
At lower resolution than 1.5A if you run two consecutive refinements, first with TLS  
1,328

edits