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Merge branch 'release-3.4.0'
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- CHANGELOG 9 additions, 0 deletionsCHANGELOG
- CMakeLists.txt 3 additions, 3 deletionsCMakeLists.txt
- cmake_support/PROMOD3.cmake 3 additions, 0 deletionscmake_support/PROMOD3.cmake
- container/Dockerfile 2 additions, 2 deletionscontainer/Dockerfile
- container/Singularity 1 addition, 1 deletioncontainer/Singularity
- core/tests/data/broken_on_purpose.chemlib 0 additions, 0 deletionscore/tests/data/broken_on_purpose.chemlib
- core/tests/test_pm3argparse.py 34 additions, 14 deletionscore/tests/test_pm3argparse.py
- doc/conf.py.in 1 addition, 1 deletiondoc/conf.py.in
- doc/dev_setup.rst 1 addition, 1 deletiondoc/dev_setup.rst
- doc/tests/test_doctests.py 1 addition, 1 deletiondoc/tests/test_doctests.py
- extras/code_generation/cullpdb_pc30.0_res0.0-2.0_len40-10000_R0.25_Xray_d2023_08_01_chains11548 11549 additions, 0 deletions...res0.0-2.0_len40-10000_R0.25_Xray_d2023_08_01_chains11548
- extras/code_generation/ideal_bb_param.py 0 additions, 220 deletionsextras/code_generation/ideal_bb_param.py
- extras/code_generation/parameter_extraction.py 443 additions, 0 deletionsextras/code_generation/parameter_extraction.py
- extras/code_generation/sidechain_atom_rule_lookup.py 0 additions, 431 deletionsextras/code_generation/sidechain_atom_rule_lookup.py
- extras/code_generation/top_all36_prot.rtf 0 additions, 1777 deletionsextras/code_generation/top_all36_prot.rtf
- extras/data_generation/afdb_modelling/afdb_proteom_to_data_chunks.py 3 additions, 3 deletions..._generation/afdb_modelling/afdb_proteom_to_data_chunks.py
- loop/pymod/export_backbone.cc 11 additions, 0 deletionsloop/pymod/export_backbone.cc
- loop/src/bb_trace_param.cc 120 additions, 120 deletionsloop/src/bb_trace_param.cc
- loop/src/bb_trace_param.hh 2 additions, 2 deletionsloop/src/bb_trace_param.hh
- loop/src/sidechain_atom_rule_lookup.cc 108 additions, 72 deletionsloop/src/sidechain_atom_rule_lookup.cc
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