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9 changes: 8 additions & 1 deletion pyproject.toml
Original file line number Diff line number Diff line change
Expand Up @@ -73,9 +73,16 @@ chem = [
"scikit-fingerprints>=1.13.1",
]

# NOTE: There is an error in the metadata of onnxruntim version 1.24.1 to 1.24.3.
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# The metadata claims that these versions are compatible with Python 3.10.
# However, Python 3.10 is not actually supported by versions >=1.24.
# As this causes issues with dependency resolving, we explicitly set the upper bound
# for onnxruntime to <1.24 for Python 3.10.
# See https://github.com/microsoft/onnxruntime/pull/27354 for more details.
onnx = [
"onnx>=1.16.0", # see AUDIT NOTE, required by skl2onnx
"onnxruntime>=1.15.1",
"onnxruntime>=1.15.1,<1.24; python_version < '3.11'",
"onnxruntime>=1.15.1; python_version >= '3.11'",
"skl2onnx>=1.19.1",
]

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3 changes: 2 additions & 1 deletion uv.lock

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