dev-python/catbench
CatBench: Benchmark Framework of Machine Learning Interatomic Potentials for Adsorption Energy Predictions in Heterogeneous Catalysis
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catbench-1.0.0
dev-python/ase[python_targets_python3_11
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,python_targets_python3_12
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,python_targets_python3_13
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,python_targets_python3_14
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>=dev-python/numpy-1.20.0[python_targets_python3_11
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,python_targets_python3_12
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,python_targets_python3_13
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,python_targets_python3_14
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]
>=dev-python/pandas-1.3.0[python_targets_python3_11
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,python_targets_python3_12
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,python_targets_python3_13
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,python_targets_python3_14
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]
>=dev-python/matplotlib-3.4.0[python_targets_python3_11
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,python_targets_python3_12
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,python_targets_python3_13
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,python_targets_python3_14
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]
>=dev-python/requests-2.25.0[python_targets_python3_11
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,python_targets_python3_12
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,python_targets_python3_13
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,python_targets_python3_14
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]
>=dev-python/xlsxwriter-3.2.0[python_targets_python3_11
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,python_targets_python3_12
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,python_targets_python3_13
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?
,python_targets_python3_14
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]
>=dev-python/pyyaml-5.4.0[python_targets_python3_11
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,python_targets_python3_12
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,python_targets_python3_13
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?
,python_targets_python3_14
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]
>=dev-python/scipy-1.7.0[python_targets_python3_11
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,python_targets_python3_12
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,python_targets_python3_13
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,python_targets_python3_14
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]
d3?
( dev-python/torch[python_targets_python3_11
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,python_targets_python3_12
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,python_targets_python3_13
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?
,python_targets_python3_14
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] )
python_targets_python3_11?
( dev-lang/python:3.11 )
python_targets_python3_12?
( dev-lang/python:3.12 )
python_targets_python3_13?
( dev-lang/python:3.13 )
python_targets_python3_14?
( dev-lang/python:3.14 )