Loading README.md +11 −5 Original line number Diff line number Diff line Loading @@ -57,14 +57,22 @@ DeepChem has a number of "soft" requirements. These are packages which are neede ### Install via conda (Recommendation) `deepchem>=2.4.0` Coming soon... `deepchem<2.4.0` ```bash conda install -c deepchem -c rdkit -c conda-forge -c omnia deepchem pip install tensorflow==1.15 conda install -c deepchem -c rdkit -c conda-forge -c omnia deepchem==2.3.0 ``` If you want GPU support: ```bash conda install -c deepchem -c rdkit -c conda-forge -c omnia deepchem-gpu conda install -y -q scikit-learn=0.22 conda install -c deepchem -c rdkit -c conda-forge -c omnia deepchem-gpu==2.3.0 ``` ### Install via pip (WIP) Loading @@ -74,9 +82,7 @@ However, pip installation is under development, so this command may not work wel `deepchem>=2.4.0` ```bash pip install joblib pandas scikit-learn tensorflow deepchem ``` Coming soon... `deepchem<2.4.0` Loading docker/2.3.0/Dockerfile +1 −0 Original line number Diff line number Diff line Loading @@ -18,6 +18,7 @@ RUN conda update -n base conda && \ conda create -y --name deepchem python=3.6 && \ . /miniconda/etc/profile.d/conda.sh && \ conda activate deepchem && \ conda install -y -q scikit-learn=0.22 && \ conda install -c deepchem -c rdkit -c conda-forge -c omnia deepchem-gpu==2.3.0 && \ conda clean -afy Loading Loading
README.md +11 −5 Original line number Diff line number Diff line Loading @@ -57,14 +57,22 @@ DeepChem has a number of "soft" requirements. These are packages which are neede ### Install via conda (Recommendation) `deepchem>=2.4.0` Coming soon... `deepchem<2.4.0` ```bash conda install -c deepchem -c rdkit -c conda-forge -c omnia deepchem pip install tensorflow==1.15 conda install -c deepchem -c rdkit -c conda-forge -c omnia deepchem==2.3.0 ``` If you want GPU support: ```bash conda install -c deepchem -c rdkit -c conda-forge -c omnia deepchem-gpu conda install -y -q scikit-learn=0.22 conda install -c deepchem -c rdkit -c conda-forge -c omnia deepchem-gpu==2.3.0 ``` ### Install via pip (WIP) Loading @@ -74,9 +82,7 @@ However, pip installation is under development, so this command may not work wel `deepchem>=2.4.0` ```bash pip install joblib pandas scikit-learn tensorflow deepchem ``` Coming soon... `deepchem<2.4.0` Loading
docker/2.3.0/Dockerfile +1 −0 Original line number Diff line number Diff line Loading @@ -18,6 +18,7 @@ RUN conda update -n base conda && \ conda create -y --name deepchem python=3.6 && \ . /miniconda/etc/profile.d/conda.sh && \ conda activate deepchem && \ conda install -y -q scikit-learn=0.22 && \ conda install -c deepchem -c rdkit -c conda-forge -c omnia deepchem-gpu==2.3.0 && \ conda clean -afy Loading
