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setup.cfg
setup.py
pyxyz.egg-info/top_level.txt
pyxyz.egg-info/SOURCES.txt
pyxyz.egg-info/dependency_links.txt
pyxyz.egg-info/PKG-INFO
pyxyz.egg-info/requires.txt
pyxyz/libgcc_s_seh-1.dll
pyxyz/molgraph.py
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pyxyz/base_load.py
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pyxyz/libstdc++-6.dll
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pyxyz/pyxyz_base.cpython-38-x86_64-linux-gnu.so
pyxyz/__init__.py
pyxyz/pyxyz_base.cpython-311-x86_64-linux-gnu.so
pyxyz/libgslcblas-0.dll
pyxyz/cpppart/cpppart.py
pyxyz/cpppart/__pycache__/cpppart.cpython-311.pyc
pyxyz/__pycache__/molgraph.cpython-311.pyc
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pyxyz/__pycache__/base_load.cpython-311.pyc
pyxyz/test/utils.py
pyxyz/test/aminoacid_ensemble.xyz
pyxyz/test/aminoacid_ensemble_current.xyz
pyxyz/test/crest_conformersA.xyz
pyxyz/test/aminoacid_ensemble_ref.xyz
pyxyz/test/geom_analysis.xyz
pyxyz/test/tests.py
pyxyz/test/__init__.py
pyxyz/test/aminoacid_single.xyz
pyxyz/test/hydrogen_atom.xyz
pyxyz/test/crest_conformersB.xyz
pyxyz/test/__pycache__/utils.cpython-311.pyc
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pyxyz/pyutils/utils.py
pyxyz/pyutils/moltopology.py
pyxyz/pyutils/__init__.py
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