branch: master 「№61880」
Commited by: Christoffer Norn
GitHub commit link: 「40e384a6650ea665」 「№6014」
Difference from previous tested commit:  code diff
Commit date: 2022-05-23 16:05:15
scientific.make_fragments.debug scientific.make_fragments

Merge pull request #6014 from RosettaCommons/cart_h_fix adding fix to default-improper, so Rosetta can fix mislabeled Q/N H-atoms

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branch: master 「№61879」
Commited by: Jack Maguire
GitHub commit link: 「1eb2c32908941b03」 「№5931」
Difference from previous tested commit:  code diff
Commit date: 2022-05-21 04:32:36
scientific.make_fragments.debug scientific.make_fragments

Merge pull request #5931 from RosettaCommons/JackMaguire/EnsureExclusivelySharedJump JumpDownstreamSelector appears to have been making some assumptions about the foldtree that result in an inverted selection. The fix checks to see if the downstream residue from the jump is selected, and inverts the selection if not.

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branch: master 「№61878」
Commited by: Ryan Kibler
GitHub commit link: 「f74a9a2cf25e7132」 「№6008」
Difference from previous tested commit:  code diff
Commit date: 2022-05-15 22:50:37

Merge pull request #6008 from RosettaCommons/rdkibler-patch-1 Fix an index bound check in KeepRegionMover

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branch: master 「№61877」
Commited by: Rocco Moretti
GitHub commit link: 「8c7751c77bd8b1d6」 「№6001」
Difference from previous tested commit:  code diff
Commit date: 2022-05-13 16:31:02

Merge pull request #6001 from RosettaCommons/roccomoretti/xsd_loading Don't load XSD citation info if we don't need it. We don't need the citation info if we're just doing schema validation (it just adjusts the description, and doesn't effect the validity of the XML). Add a (default true) flag we can set to false to turn off generating and including the citation info string just for XML validation. (The XSD dump and the info tags still will include the citation info.) This cleans up tracer output (e.g. it doesn't print warnings and setup noise from all of the Movers etc. which were previously being instantiated. It also avoids crashes due to mover instantiation issues.

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branch: master 「№61876」
Commited by: Hope Woods
GitHub commit link: 「e3a59b3b1f22ce03」 「№5995」
Difference from previous tested commit:  code diff
Commit date: 2022-05-10 12:39:47

Merge pull request #5995 from RosettaCommons/woodsh17/fix_mp_scientific_test Adding -restore_lazaridis_imm_behavior 1 to MP scientific test

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branch: master 「№61875」
Commited by: Sergey Lyskov
GitHub commit link: 「4040fe53a2587187」
Difference from previous tested commit:  code diff
Commit date: 2022-05-05 17:40:30

increasing default memory requirements for SLURM HPC jobs

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branch: master 「№61874」
Commited by: Andy Watkins
GitHub commit link: 「b7a135cdaa7db2b5」 「№2403」
Difference from previous tested commit:  code diff
Commit date: 2022-04-26 09:33:46

Merge pull request #2403 from RosettaCommons/vmullig/beta_mainchain_potentials Add support for beta-amino acids in macrocycle structure prediction

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branch: master 「№61873」
Commited by: Vikram K. Mulligan
GitHub commit link: 「656a27f77a5eefbe」 「№5976」
Difference from previous tested commit:  code diff
Commit date: 2022-04-25 20:16:42

Merge pull request #5976 from RosettaCommons/vmullig/update_tools Update tools submodule to reflect small tweak. In the auto-generated docs, asterisks in citations were resulting in italics. I've updated the tools repo so that the script uses literal asterisks (with a backslash to avoid italics). This PR just updates the tools and documentation submodules to point to the latest master versions of these repos.

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branch: master 「№61872」
Commited by: Justin Seffernick
GitHub commit link: 「c56c7a7961416151」 「№5902」
Difference from previous tested commit:  code diff
Commit date: 2022-04-22 14:40:27

Merge pull request #5902 from RosettaCommons/jtseffer/ERMS_prediction Jtseffer/erms prediction

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branch: master 「№61871」
Commited by: Hope Woods
GitHub commit link: 「3563711deecfb51a」 「№5965」
Difference from previous tested commit:  code diff
Commit date: 2022-04-21 11:06:53

Merge pull request #5965 from RosettaCommons/woodsh17/fix_clang_tidy_test clang_tidy_fix

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branch: master 「№61870」
Commited by: Vikram K. Mulligan
GitHub commit link: 「839b00f59d92ff52」 「№5962」
Difference from previous tested commit:  code diff
Commit date: 2022-04-19 17:48:30

Merge pull request #5962 from RosettaCommons/vmullig/fix_unit_test_breakage_from_packer_change Fix unit test breakage, and restore skipping of final temperature jump in packing This reverts pull request #5960 to restore pull request #5920, and fixes the unit test failure in the process. TODO: - [x] Fix failure in `AntibodySeqDesign:test_normal_tf_generation` unit test. --> A UTracer can simply be updated. The difference is likely a trajectory difference.

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branch: master 「№61869」
Commited by: Hope Woods
GitHub commit link: 「6d1be2f68a603971」 「№4571」
Difference from previous tested commit:  code diff
Commit date: 2022-04-19 17:43:45

Merge pull request #4571 from RosettaCommons/woodsh17/mem_geo Woodsh17/mem geo

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branch: master 「№61868」
Commited by: Vikram K. Mulligan
GitHub commit link: 「f0483100f2878832」 「№5915」
Difference from previous tested commit:  code diff
Commit date: 2022-04-18 17:52:10

Merge pull request #5915 from RosettaCommons/vmullig/restore_citations_in_docs Revert the reversion to put citation info back into the docs - [x] Add performance test that checks time to instantiate each mover, filter, etc. in sequence. - [x] Identify high-cost movers, and fix these so that they can be instantiated without high cost. - Done for some, and I've reduced the runtime by ~50% when instantiating all movers. Could still be better, though. The question is whether this is good enough. - [x] Pull request #5916 must be merged before this one.

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branch: master 「№61867」
Commited by: Vikram K. Mulligan
GitHub commit link: 「a5461a21d0122c17」 「№5960」
Difference from previous tested commit:  code diff
Commit date: 2022-04-18 14:32:53

Merge pull request #5960 from RosettaCommons/revert-5920-JackMaguire/PackerSkipTemp4 Revert "Skip final temperature raise in the default packer" temporarily, until unit test failure can be fixed.

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branch: master 「№61866」
Commited by: Jack Maguire
GitHub commit link: 「fd4e9dcf7eb660a9」 「№5920」
Difference from previous tested commit:  code diff
Commit date: 2022-04-14 21:21:58

Merge pull request #5920 from RosettaCommons/JackMaguire/PackerSkipTemp4 Skip final temperature raise in the default packer

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branch: master 「№61865」
Commited by: Brahm Yachnin
GitHub commit link: 「ceaeef0639d13c96」
Difference from previous tested commit:  code diff
Commit date: 2022-04-10 20:37:59

RosettaAI: Setting rosetta_scripts_scripts submodule to latest origin/master version.

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