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fix: make readme more succinct
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fiskrt committed Jun 11, 2024
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Expand Up @@ -9,12 +9,7 @@ cd gt4sd-core/
conda env create -f conda_gpu.yml
conda activate gt4sd
pip install gt4sd
```

Uninstall and reinstall toxsmi using `pip` to get correct version:
```bash
pip uninstall toxsmi
pip install toxsmi
pip uninstall --yes toxsmi && pip install toxsmi
```

### (Optional) Download data from [BindingDB](https://www.bindingdb.org/bind/BindingDBRESTfulAPI.jsp)
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