Merge pull request #5254 from RosettaCommons/jkleman/SciBen_more_fixes
Jkleman/sci ben more fixes: fixed RosettaCM test by adjusting cutoffs, fixed glycan structure prediction
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Merge pull request #5263 from RosettaCommons/vmullig/clangfix_deer
Fix a small issue in the DEER code that clang-tidy complained about
This should fix the clang-tidy test.
Tasks:
- [x] Make type of inner product explicit.
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Merge PR #5246: Carbohydrate-oriented changes needed before integrating GlycanDock protocol into master
Assuming the changes seen in swm_dna_bridge aren't due to this PR as it has been showing changes in previous merges
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Merge pull request #4818 from RosettaCommons/jadolfbr/rabd_updates
Thanks to @rahelf and @skelow for identifying these bugs and their aid in fixing them!
Bug Fixes
=======
- `INCLUDE_ONLY` was not being read, and this was used in the documentation - and should be main CDRSet option.
- Fixed issue where the final cluster reported could be different than what the cluster actually was through `identify_cdr_clusters` app
- Removed the constructor that takes an ab_info object. ab_info is now always correctly initialized from pose.
- This also fixes light_chain not being correctly set from xml/pyrosetta.
Optimizations
==========
- High Res dock cycles have been greatly reduced to speed up integrated docking and allow more robust protocols. Options are now present to control the first and second cycles of the DockMCM (high-res) protocol in cmd-line,RS, and in code.
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Merge pull request #4901 from RosettaCommons/jadolfbr/nbr_res_selector
Add a per-residue SimpleMetric, SideChainNeighborCountMetric, to count sidechain neighbors in the same way that LayerDesign works.
Refactor LayerSelector to enable the use of the same core code to do the calculations.
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Merge pull request #5251 from RosettaCommons/roccomoretti/cleanup_code_templates
Clean up code templates.
There were some issues with the formatting of code templates (stray whitespace, missing quotes).
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Merge pull request #5227 from RosettaCommons/jadolfbr/update_notebook_header
Point notebook version to current, which includes bugfixes in RS integration notebook.
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