LICENSE
MANIFEST.in
README.md
requirements.txt
setup.py
Fragmenstein.egg-info/PKG-INFO
Fragmenstein.egg-info/SOURCES.txt
Fragmenstein.egg-info/dependency_links.txt
Fragmenstein.egg-info/entry_points.txt
Fragmenstein.egg-info/requires.txt
Fragmenstein.egg-info/top_level.txt
fragmenstein/__init__.py
fragmenstein/branding.py
fragmenstein/divergent_colors.json
fragmenstein/legacy.py
fragmenstein/m_rmsd.py
fragmenstein/cli/__init__.py
fragmenstein/demo/__init__.py
fragmenstein/demo/_base_dataset_holder.py
fragmenstein/demo/mac1_mols/__init__.py
fragmenstein/demo/mac1_mols/diamond-x0091_B.mol
fragmenstein/demo/mac1_mols/diamond-x0104_A.mol
fragmenstein/demo/mac1_mols/diamond-x0128_A.mol
fragmenstein/demo/mac1_mols/diamond-x0142_A.mol
fragmenstein/demo/mac1_mols/diamond-x0158_B.mol
fragmenstein/demo/mac1_mols/diamond-x0159_B.mol
fragmenstein/demo/mac1_mols/diamond-x0173_B.mol
fragmenstein/demo/mac1_mols/diamond-x0216_A.mol
fragmenstein/demo/mac1_mols/diamond-x0228_B.mol
fragmenstein/demo/mac1_mols/diamond-x0253_A.mol
fragmenstein/demo/mac1_mols/diamond-x0259_A.mol
fragmenstein/demo/mac1_mols/diamond-x0282_A.mol
fragmenstein/demo/mac1_mols/diamond-x0290_A.mol
fragmenstein/demo/mac1_mols/diamond-x0299_A.mol
fragmenstein/demo/mac1_mols/diamond-x0301_B.mol
fragmenstein/demo/mac1_mols/diamond-x0334_A.mol
fragmenstein/demo/mac1_mols/diamond-x0371_A.mol
fragmenstein/demo/mac1_mols/diamond-x0380_B.mol
fragmenstein/demo/mac1_mols/diamond-x0417_B.mol
fragmenstein/demo/mac1_mols/diamond-x0421_A.mol
fragmenstein/demo/mac1_mols/diamond-x0423_B.mol
fragmenstein/demo/mac1_mols/diamond-x0436_B.mol
fragmenstein/demo/mac1_mols/diamond-x0438_A.mol
fragmenstein/demo/mac1_mols/diamond-x0465_A.mol
fragmenstein/demo/mac1_mols/diamond-x0469_B.mol
fragmenstein/demo/mac1_mols/diamond-x0471_A.mol
fragmenstein/demo/mac1_mols/diamond-x0496_A.mol
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fragmenstein/demo/mac1_mols/diamond-x0524_A.mol
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fragmenstein/demo/mac1_mols/diamond-x0591_A.mol
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fragmenstein/demo/mac1_mols/diamond-x0631_A.mol
fragmenstein/demo/mac1_mols/diamond-x0655_B.mol
fragmenstein/demo/mac1_mols/diamond-x0662_A.mol
fragmenstein/demo/mac1_mols/diamond-x0676_B.mol
fragmenstein/demo/mac1_mols/diamond-x0681_A.mol
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fragmenstein/demo/mac1_mols/diamond-x0727_A.mol
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fragmenstein/demo/mac1_mols/diamond-x0737_B.mol
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fragmenstein/demo/mac1_mols/diamond-x0766_A.mol
fragmenstein/demo/mac1_mols/diamond-x0792_A.mol
fragmenstein/demo/mac1_mols/diamond-x0796_B.mol
fragmenstein/demo/mac1_mols/diamond-x0797_B.mol
fragmenstein/demo/mac1_mols/diamond-x0805_A.mol
fragmenstein/demo/mac1_mols/diamond-x0814_B.mol
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fragmenstein/igor/__init__.py
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fragmenstein/igor/_igor_utils.py
fragmenstein/igor/pyrosetta_import.py
fragmenstein/laboratory/__init__.py
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fragmenstein/monster/_combine.py
fragmenstein/monster/_communal.py
fragmenstein/monster/_join_neighboring.py
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fragmenstein/monster/bond_provenance.py
fragmenstein/monster/positional_mapping.py
fragmenstein/monster/unmerge_mapper.py
fragmenstein/monster/_place_modes/__init__.py
fragmenstein/monster/_place_modes/_expand.py
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fragmenstein/monster/_place_modes/_mappings.py
fragmenstein/monster/_place_modes/_no_blending.py
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fragmenstein/monster/_place_modes/_refine.py
fragmenstein/monster/mcs_mapping/__init__.py
fragmenstein/monster/mcs_mapping/compare_atom.py
fragmenstein/monster/mcs_mapping/types.py
fragmenstein/monster/mcs_mapping/utils.py
fragmenstein/mpro/__init__.py
fragmenstein/mpro/dataframe.py
fragmenstein/multivictor/__init__.py
fragmenstein/multivictor/multivictor.py
fragmenstein/victor/__init__.py
fragmenstein/victor/_loggerwriter.py
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fragmenstein/victor/_victor_combine.py
fragmenstein/victor/_victor_common.py
fragmenstein/victor/_victor_igor.py
fragmenstein/victor/_victor_journal.py
fragmenstein/victor/_victor_overridables.py
fragmenstein/victor/_victor_place.py
fragmenstein/victor/_victor_plonk.py
fragmenstein/victor/_victor_safety.py
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fragmenstein/victor/_victor_validate.py
fragmenstein/victor/minimalPDB.py
fragmenstein/walton/__init__.py
fragmenstein/walton/_advmoves.py
fragmenstein/walton/_art.py
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fragmenstein/walton/_movements.py
fragmenstein/walton/_polygon.py
tests/MPro_combine.py
tests/MPro_place.py
tests/__init__.py
tests/internals.py
tests/mapping.py
tests/monster_combine.py
tests/monster_place.py
tests/multivictor.py
tests/problems.py
tests/walton.py