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Revisions №62140

branch: rosetta:main 「№62140」
Commited by: Rocco Moretti
GitHub commit link: 「26484dedf0f1404f」
Difference from previous tested commit:  code diff
Commit date: 2024-12-16 19:26:02
linux.clang linux.gcc linux.srlz mac.clang
debug
release
unit
PyRosetta.notebook gcc-9.gcc.python37.PyRosetta.unit mac.clang.python38.PyRosetta.unit ubuntu-20.04.clang.cxx11thread.serialization.PyRosetta.unit ubuntu-20.04.clang.python310.PyRosetta.unit ubuntu-20.04.clang.python311.PyRosetta.unit ubuntu-20.04.clang.python312.PyRosetta.unit ubuntu-20.04.clang.python313.PyRosetta.unit ubuntu-20.04.clang.python38.PyRosetta.unit ubuntu-20.04.clang.python39.PyRosetta.unit ubuntu-20.04.gcc.cxx11thread.serialization.PyRosetta.unit ubuntu-20.04.gcc.python310.PyRosetta.unit ubuntu-20.04.gcc.python311.PyRosetta.unit ubuntu-20.04.gcc.python312.PyRosetta.unit ubuntu-20.04.gcc.python313.PyRosetta.unit ubuntu-20.04.gcc.python38.PyRosetta.unit ubuntu-20.04.gcc.python39.PyRosetta.unit ubuntu-22.04.clang.cxx11thread.serialization.PyRosetta.unit ubuntu-22.04.clang.python310.PyRosetta.unit ubuntu-22.04.clang.python311.PyRosetta.unit ubuntu-22.04.clang.python312.PyRosetta.unit ubuntu-22.04.clang.python313.PyRosetta.unit ubuntu-22.04.clang.python38.PyRosetta.unit 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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 mac.clang.python310.release.PyRosetta.Release mac.clang.python311.release.PyRosetta.Release mac.clang.python312.release.PyRosetta.Release mac.clang.python313.release.PyRosetta.Release mac.clang.python38.release.PyRosetta.Release mac.clang.python39.release.PyRosetta.Release ubuntu.clang.python310.release.PyRosetta.Release ubuntu.clang.python311.release.PyRosetta.Release ubuntu.clang.python312.release.PyRosetta.Release ubuntu.clang.python313.release.PyRosetta.Release ubuntu.clang.python38.release.PyRosetta.Release ubuntu.clang.python39.release.PyRosetta.Release 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scientific.ligand_docking scientific.ligand_scoring_ranking.debug scientific.ligand_scoring_ranking scientific.loop_modeling_ccd_12res.debug scientific.loop_modeling_ccd_12res scientific.loop_modeling_kic_12res.debug scientific.loop_modeling_kic_12res scientific.loop_modeling_kic_fragments_12res.debug scientific.loop_modeling_kic_fragments_12res scientific.loop_modeling_ngk_12res.debug scientific.loop_modeling_ngk_12res scientific.make_fragments.debug scientific.make_fragments scientific.mhc_epitope_energy.debug scientific.mhc_epitope_energy scientific.mp_dock.debug scientific.mp_dock scientific.mp_domain_assembly.debug scientific.mp_domain_assembly scientific.mp_f19_decoy_discrimination.debug scientific.mp_f19_decoy_discrimination scientific.mp_f19_sequence_recovery.debug scientific.mp_f19_sequence_recovery scientific.mp_f19_tilt_angle.debug scientific.mp_f19_tilt_angle scientific.mp_lipid_acc.debug scientific.mp_lipid_acc scientific.mp_relax.debug scientific.mp_relax scientific.mp_symdock.debug scientific.mp_symdock scientific.peptide_pnear_vs_ic50.debug scientific.peptide_pnear_vs_ic50 scientific.protein_data_bank_diagnostic.cif scientific.protein_data_bank_diagnostic.full 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.simple_cycpep_predict.debug scientific.simple_cycpep_predict scientific.stepwise_rna_favorites.debug scientific.stepwise_rna_favorites 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 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 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Fix issue related to PackerTask usage in homodimer_design. (#115) With a -pack_min_runs of 2 or greater, there's a chance that the sequence of the structure changes. This is a problem for a fixed PackerTask run, as `task_is_valid( pose )` fails if the base residue types don't match up properly. This is an issue found in Discussion #112 The fix is simple -- just use the TaskFactory which we already have lying around instead of manually generating the packer task. (The PackRotamersMover will properly re-apply the TaskFactory.) We can also make the interface of PackRotamersMover a bit nicer.

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

Failed sub-tests (click for more details):
replica_docking
Test: ubuntu.gcc.integration.ubsan

Failed sub-tests (click for more details):
code_template_tests_src
Test: ubuntu-20.04.clang.python36.scientific.docking

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

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Test: ubuntu-20.04.gcc.mpi.serialization.python36.scientific.glycan_structure_prediction

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Test: ubuntu-20.04.clang.python36.scientific.make_fragments.debug

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

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Test: ubuntu-20.04.clang.python36.scientific.mp_f19_decoy_discrimination.debug

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Test: ubuntu-20.04.clang.python36.scientific.mp_f19_decoy_discrimination

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

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

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Test: ubuntu-20.04.gcc.cxx11thread.mpi.serialization.python36.scientific.peptide_pnear_vs_ic50.debug

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Test: ubuntu-20.04.gcc.cxx11thread.mpi.serialization.python36.scientific.peptide_pnear_vs_ic50

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Test: ubuntu-20.04.clang.python36.scientific.protein_data_bank_diagnostic.cif

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Test: ubuntu-20.04.clang.python36.scientific.protein_data_bank_diagnostic.full

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Test: ubuntu-20.04.gcc.cxx11thread.mpi.serialization.python36.scientific.simple_cycpep_predict.debug

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Test: ubuntu-20.04.gcc.cxx11thread.mpi.serialization.python36.scientific.simple_cycpep_predict

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Test: linux.gcc.unit.valgrind

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