"lib/bindings/git@developer.sourcefind.cn:OpenDAS/dynamo.git" did not exist on "974201c869d883f6f8ca8f716f743844fab6951a"
Commit 942f4d6e authored by Vaclav Hanzl's avatar Vaclav Hanzl
Browse files

Advance python version to 3.9 to build docker in Ubuntu Lunar Lobster

parent b5fa2ba3
...@@ -31,6 +31,6 @@ COPY setup.py /opt/openfold/setup.py ...@@ -31,6 +31,6 @@ COPY setup.py /opt/openfold/setup.py
COPY lib/openmm.patch /opt/openfold/lib/openmm.patch COPY lib/openmm.patch /opt/openfold/lib/openmm.patch
RUN wget -q -P /opt/openfold/openfold/resources \ RUN wget -q -P /opt/openfold/openfold/resources \
https://git.scicore.unibas.ch/schwede/openstructure/-/raw/7102c63615b64735c4941278d92b554ec94415f8/modules/mol/alg/src/stereo_chemical_props.txt https://git.scicore.unibas.ch/schwede/openstructure/-/raw/7102c63615b64735c4941278d92b554ec94415f8/modules/mol/alg/src/stereo_chemical_props.txt
RUN patch -p0 -d /opt/conda/lib/python3.7/site-packages/ < /opt/openfold/lib/openmm.patch RUN patch -p0 -d /opt/conda/lib/python3.9/site-packages/ < /opt/openfold/lib/openmm.patch
WORKDIR /opt/openfold WORKDIR /opt/openfold
RUN python3 setup.py install RUN python3 setup.py install
...@@ -4,7 +4,7 @@ channels: ...@@ -4,7 +4,7 @@ channels:
- bioconda - bioconda
- pytorch - pytorch
dependencies: dependencies:
- conda-forge::python=3.7 - conda-forge::python=3.9
- conda-forge::setuptools=59.5.0 - conda-forge::setuptools=59.5.0
- conda-forge::pip - conda-forge::pip
- conda-forge::openmm=7.5.1 - conda-forge::openmm=7.5.1
......
...@@ -27,7 +27,7 @@ cd $CUR_DIR ...@@ -27,7 +27,7 @@ cd $CUR_DIR
# Install DeepMind's OpenMM patch # Install DeepMind's OpenMM patch
OPENFOLD_DIR=$PWD OPENFOLD_DIR=$PWD
pushd lib/conda/envs/$ENV_NAME/lib/python3.7/site-packages/ \ pushd lib/conda/envs/$ENV_NAME/lib/python3.9/site-packages/ \
&& patch -p0 < $OPENFOLD_DIR/lib/openmm.patch \ && patch -p0 < $OPENFOLD_DIR/lib/openmm.patch \
&& popd && popd
......
...@@ -128,7 +128,7 @@ setup( ...@@ -128,7 +128,7 @@ setup(
classifiers=[ classifiers=[
'License :: OSI Approved :: Apache Software License', 'License :: OSI Approved :: Apache Software License',
'Operating System :: POSIX :: Linux', 'Operating System :: POSIX :: Linux',
'Programming Language :: Python :: 3.7,' 'Programming Language :: Python :: 3.9,'
'Topic :: Scientific/Engineering :: Artificial Intelligence', 'Topic :: Scientific/Engineering :: Artificial Intelligence',
], ],
) )
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