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simonduerr commited on
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28f197f
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1 Parent(s): b84582b

Update Dockerfile

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  1. Dockerfile +1 -1
Dockerfile CHANGED
@@ -9,7 +9,7 @@ COPY . .
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  RUN pip3 install rdkit==2023.9.6 pandas==2.1.4 posebusters==0.2.7
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  RUN pip3 install gradio gradio_molecule3d
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- RUN pip3 setuptools --upgrade
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  RUN pip3 install git+https://github.com/acellera/moleculekit.git
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  RUN git clone https://github.com/rlabduke/reduce.git && cd reduce && make && make install
 
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  RUN pip3 install rdkit==2023.9.6 pandas==2.1.4 posebusters==0.2.7
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  RUN pip3 install gradio gradio_molecule3d
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+ RUN pip3 install setuptools --upgrade
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  RUN pip3 install git+https://github.com/acellera/moleculekit.git
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  RUN git clone https://github.com/rlabduke/reduce.git && cd reduce && make && make install