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Remove Penultimate Rotamer Lib
For optimal usage of the Penultimate library, one needs to consider the secondary structure, as there are specific rotamer probabilities for helices, sheets, coils. We're currently not doing that and would need to adapt some code in the sidechain reconstruction algorithms. Lets remove the Penultimate Lib for now and use a custom backbone independent lib instead.
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- doc/portableIO.rst 1 addition, 1 deletiondoc/portableIO.rst
- extras/data_generation/portable_binaries/convert_data.cc 3 additions, 3 deletionsextras/data_generation/portable_binaries/convert_data.cc
- extras/data_generation/rotamer_library/README 49 additions, 56 deletionsextras/data_generation/rotamer_library/README
- extras/data_generation/rotamer_library/create_penultimate.py 0 additions, 1384 deletionsextras/data_generation/rotamer_library/create_penultimate.py
- extras/data_generation/rotamer_library/do_lib.py 324 additions, 0 deletionsextras/data_generation/rotamer_library/do_lib.py
- extras/data_generation/rotamer_library/penultimate.csv 0 additions, 211 deletionsextras/data_generation/rotamer_library/penultimate.csv
- modelling/doc/sidechain_reconstruction.rst 1 addition, 1 deletionmodelling/doc/sidechain_reconstruction.rst
- modelling/src/sidechain_env_listener.cc 2 additions, 2 deletionsmodelling/src/sidechain_env_listener.cc
- modelling/tests/test_sidechain_reconstruction.py 1 addition, 1 deletionmodelling/tests/test_sidechain_reconstruction.py
- sidechain/data/CMakeLists.txt 1 addition, 1 deletionsidechain/data/CMakeLists.txt
- sidechain/data/portable_PenultimateLib.dat 0 additions, 0 deletionssidechain/data/portable_PenultimateLib.dat
- sidechain/data/portable_lib.dat 0 additions, 0 deletionssidechain/data/portable_lib.dat
- sidechain/doc/loading.rst 7 additions, 8 deletionssidechain/doc/loading.rst
- sidechain/pymod/export_sidechain_object_loader.cc 1 addition, 1 deletionsidechain/pymod/export_sidechain_object_loader.cc
- sidechain/src/sidechain_object_loader.cc 3 additions, 3 deletionssidechain/src/sidechain_object_loader.cc
- sidechain/src/sidechain_object_loader.hh 1 addition, 1 deletionsidechain/src/sidechain_object_loader.hh
- sidechain/tests/test_rotamers.cc 2 additions, 2 deletionssidechain/tests/test_rotamers.cc
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