.gitignore
CITATION.cff
LICENSE
MANIFEST.in
README.md
openkim_archive.json
pyproject.toml
setup.py
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atomisticparsers/__init__.py
atomisticparsers/amber/README.md
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atomisticparsers/amber/__main__.py
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atomisticparsers/amber/metainfo/amber.py
atomisticparsers/asap/README.md
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atomisticparsers/bopfox/README.md
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atomisticparsers/bopfox/metainfo/bopfox.py
atomisticparsers/dftbplus/README.md
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atomisticparsers/dftbplus/metainfo/dftbplus.py
atomisticparsers/dlpoly/README.md
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atomisticparsers/dlpoly/metainfo/dl_poly.py
atomisticparsers/gromacs/README.md
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atomisticparsers/gromacs/metainfo/gromacs.py
atomisticparsers/gromos/README.md
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atomisticparsers/gromos/metainfo/gromos.py
atomisticparsers/gulp/README.md
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atomisticparsers/h5md/README.md
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atomisticparsers/lammps/README.md
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atomisticparsers/libatoms/README.md
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atomisticparsers/namd/README.md
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atomisticparsers/utils/__init__.py
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atomisticparsers/utils/parsers.py
atomisticparsers/xtb/README.md
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tests/__init__.py
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tests/test_bopfoxparser.py
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tests/data/gromacs/water_AA_ENUM_tests/integrator-sd/state.cpt
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tests/data/gulp/example8/example8.gin
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tests/data/h5md/openmm/test_traj_openmm_5frames.h5
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