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SCHWED-882: tested external ff passing and added parameters to BuildFromRawModel
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- modelling/pymod/_closegaps.py 2 additions, 1 deletionmodelling/pymod/_closegaps.py
- modelling/pymod/_pipeline.py 34 additions, 24 deletionsmodelling/pymod/_pipeline.py
- modelling/tests/CMakeLists.txt 2 additions, 0 deletionsmodelling/tests/CMakeLists.txt
- modelling/tests/data/ff_NAD.dat 0 additions, 0 deletionsmodelling/tests/data/ff_NAD.dat
- modelling/tests/data/smtl2bl4.1.pdb 5919 additions, 0 deletionsmodelling/tests/data/smtl2bl4.1.pdb
- modelling/tests/test_pipeline.py 33 additions, 0 deletionsmodelling/tests/test_pipeline.py
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