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adding automatic conversion of non-standard amino-acids to standard ones, in...
adding automatic conversion of non-standard amino-acids to standard ones, in case parent residue is not the same only BB will be copied;CB will be inserted where possible if copying from a GLY
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- modules/conop/pymod/CMakeLists.txt 1 addition, 0 deletionsmodules/conop/pymod/CMakeLists.txt
- modules/conop/pymod/export_non_standard.cc 50 additions, 0 deletionsmodules/conop/pymod/export_non_standard.cc
- modules/conop/pymod/wrap_conop.cc 3 additions, 0 deletionsmodules/conop/pymod/wrap_conop.cc
- modules/conop/src/CMakeLists.txt 3 additions, 1 deletionmodules/conop/src/CMakeLists.txt
- modules/conop/src/nonstandard.cc 265 additions, 0 deletionsmodules/conop/src/nonstandard.cc
- modules/conop/src/nonstandard.hh 97 additions, 0 deletionsmodules/conop/src/nonstandard.hh
- modules/conop/tests/CMakeLists.txt 1 addition, 0 deletionsmodules/conop/tests/CMakeLists.txt
- modules/conop/tests/test_nonstandard.py 123 additions, 0 deletionsmodules/conop/tests/test_nonstandard.py
- modules/conop/tests/testfiles/cbeta.pdb 27 additions, 0 deletionsmodules/conop/tests/testfiles/cbeta.pdb
- modules/conop/tests/testfiles/sep.pdb 10 additions, 0 deletionsmodules/conop/tests/testfiles/sep.pdb
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