1,330
edits
Phenix: Difference between revisions
Jump to navigation
Jump to search
→NCS
(→NCS) |
|||
| Line 270: | Line 270: | ||
==== NCS ==== | ==== NCS ==== | ||
Automatic detection of NCS groups: | * Automatic detection of NCS groups: | ||
phenix.refine data.hkl model.pdb main.ncs=True | phenix.refine data.hkl model.pdb main.ncs=True | ||
* Manual specification of NCS groups: | |||
Manual specification of NCS groups: | |||
phenix.refine data.hkl model.pdb ncs_groups.params main.ncs=True | phenix.refine data.hkl model.pdb ncs_groups.params main.ncs=True | ||
where ncs_groups.params contains e.g.: | where ncs_groups.params contains e.g.: | ||
| Line 286: | Line 284: | ||
selection = chain F | selection = chain F | ||
} | } | ||
* switching to torsion-angle NCS: | |||
ncs.type=torsion | |||
* switch off the restraints on NCS-related B-factors: | |||
ncs.b_factor_weight=0 | |||
==== Secondary structure restraints ==== | ==== Secondary structure restraints ==== | ||