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Revisions №62176

branch: rosetta:main 「№62176」
Commited by: Jason C. Klima
GitHub commit link: 「c07e51cae6c8448b」
Difference from previous tested commit:  code diff
Commit date: 2025-07-11 11:50:06
linux.clang linux.gcc linux.srlz mac.clang
debug
release
unit
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m1.clang.python310.release.PyRosetta.MinSizeRel m1.clang.python311.release.PyRosetta.MinSizeRel m1.clang.python312.release.PyRosetta.MinSizeRel m1.clang.python313.release.PyRosetta.MinSizeRel m1.clang.python38.release.PyRosetta.MinSizeRel m1.clang.python39.release.PyRosetta.MinSizeRel mac.clang.python310.release.PyRosetta.MinSizeRel mac.clang.python311.release.PyRosetta.MinSizeRel mac.clang.python312.release.PyRosetta.MinSizeRel mac.clang.python313.release.PyRosetta.MinSizeRel mac.clang.python38.release.PyRosetta.MinSizeRel mac.clang.python39.release.PyRosetta.MinSizeRel ubuntu.clang.python310.release.PyRosetta.MinSizeRel ubuntu.clang.python311.release.PyRosetta.MinSizeRel ubuntu.clang.python312.release.PyRosetta.MinSizeRel ubuntu.clang.python313.release.PyRosetta.MinSizeRel ubuntu.clang.python38.release.PyRosetta.MinSizeRel ubuntu.clang.python39.release.PyRosetta.MinSizeRel m1.clang.python310.release.PyRosetta.Release m1.clang.python311.release.PyRosetta.Release 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scientific.cofactor_binding_sites scientific.docking scientific.enzyme_design.debug scientific.enzyme_design scientific.glycan_dock scientific.glycan_structure_prediction.debug scientific.ligand_scoring_ranking.debug scientific.ligand_scoring_ranking scientific.loop_modeling_ccd_12res.debug scientific.loop_modeling_ccd_12res scientific.loop_modeling_kic_fragments_12res scientific.loop_modeling_ngk_12res scientific.make_fragments scientific.mhc_epitope_energy.debug scientific.mp_domain_assembly.debug scientific.mp_lipid_acc.debug scientific.mp_lipid_acc scientific.mp_relax.debug scientific.mp_symdock.debug scientific.relax_cartesian scientific.relax_fast.debug scientific.relax_fast_5iter.debug scientific.relax_fast_5iter scientific.relax_fast scientific.rna_denovo_favorites.debug scientific.rna_denovo_favorites scientific.sewing.debug scientific.sewing scientific.stepwise_rna_favorites.debug linux.clang.score linux.gcc.score mac.clang.score scripts.pyrosetta scripts.rosetta.parse scripts.rosetta.validate scripts.rosetta.verify unit.addsan linux.clang.unit.release linux.gcc.unit.release mac.clang.unit.release unit.ubsan unit.valgrind gcc-10.gcc.cxx11thread.serialization.unit gcc-10.gcc.unit gcc-11.gcc.cxx11thread.serialization.unit gcc-11.gcc.unit gcc-9.gcc.cxx11thread.serialization.unit gcc-9.gcc.unit linux.clang.python310.unit linux.clang.python311.unit linux.clang.python312.unit linux.clang.python38.unit linux.clang.python39.unit linux.gcc.python310.unit linux.gcc.python311.unit linux.gcc.python312.unit linux.gcc.python38.unit linux.gcc.python39.unit m1.clang.cxx11thread.serialization.unit m1.clang.python310.unit m1.clang.python311.unit m1.clang.python312.unit m1.clang.python313.unit m1.clang.python38.unit m1.clang.python39.unit m1.clang.unit mac.clang.cxx11thread.serialization.unit mac.clang.python310.unit mac.clang.python311.unit mac.clang.python312.unit mac.clang.python313.unit mac.clang.python38.unit mac.clang.python39.unit 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util.apps windows.build.debug windows.build.release

Enable Pose.scores dictionary to store arbitrary python objects (#430) * Fix KeyError for string objects * Serialize and deserialize values in pose scores dictionary * Update TypeError message * Maybe deserialize ScoreMap.get_arbitrary_string_data_from_pose data * Test PyJobDistributor with arbitrary scoretypes * Test SimpleMetric implementation * Fix NotImplementedError * Update unit tests that assert that float values are rounded upon score set/get round trips * Add warnings for setPoseExtraScore float value precision change, type casting, and possible UnicodeDecodeError * Update import * Update reserved scoretypes * Add rounding difference to warning message * Update imports * Initial refactor of pose.cache dictionary * Add pose.cache unit tests * Remove numpy dependency for non-serialization builds * Change pose.scores to pose.cache * Move pose.cache into modules for comprehensibility * Use pose.cache instead of packed_pose.update_scores * Set clobber warnings in pose.scores * Add deprecation warning to pose.scores * Add warning if key in immutable SimpleMetrics data exists * Clean up * Setting PackedPose.scores to Pose.cache * Set cache with packed_pose.update_scores * Fix warning * Reserve pose.cache keys * Update warning messages * Update warning message * Update PackedPose.scores dictionary with pose.cache * Update logging message test * Update reserve_scores decorator to be using pose.cache * Add update_scores in reserve_scores * Update version * Add syntax warning for setting PackedPose.scores items * Test saving detached scores in the PackedPose.scores dictionary * Improve docstring example * Update docstrings * Clean up * Split into separate warnings when deleting reserved scoretypes * Return nested MappingProxyType read-only data by pose.cache.all_scores * Update docstrings * Minor tweaks to docstrings * Clean up applying SimpleMetrics to the pose * Validate strict base64

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Test: ubuntu.gcc.integration.addsan

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Test: linux.gcc.mpi.serialization.integration.mpi

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Test: linux.clang.integration.tutorials

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Test: linux.clang.maintenance.documentation

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Test: ubuntu-20.04.clang.python36.scientific.mp_lipid_acc

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