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mak installation pypi-compatible
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README.md

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@@ -6,8 +6,13 @@ A web application for the ensemble is available at https://chebifier.hastingslab
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## Installation
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Note: `chebai-graph` and its dependencies cannot be installed automatically. To install it, follow
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the instructions in the [chebai-graph repository](https://github.com/ChEB-AI/python-chebai-graph). Other dependencies are installed automatically.
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Not all models can be installed automatically at the moment:
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- `chebai-graph` and its dependencies. To install them, follow
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the instructions in the [chebai-graph repository](https://github.com/ChEB-AI/python-chebai-graph).
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- `chemlog-extra` can be installed with `pip install git+https://github.com/ChEB-AI/chemlog-extra.git`
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- The automatically installed version of `c3p` may not work under Windows. If you want to run chebifier on Windows, we
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recommend using this forked version: `pip install git+https://github.com/sfluegel05/c3p.git`
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You can get the package from PyPI:
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```bash

pyproject.toml

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"rdkit",
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"chebai>=1.0.1",
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"chemlog>=1.0.4",
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"chemlog_extra @ git+https://github.com/ChEB-AI/chemlog-extra.git",
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# pypi does not support git dependencies
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#"chemlog_extra @ git+https://github.com/ChEB-AI/chemlog-extra.git",
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"c3p"
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# forked version of c3p is windows-compatible
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"c3p @ git+https://github.com/sfluegel05/c3p.git"
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#"c3p @ git+https://github.com/sfluegel05/c3p.git"
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]
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