tdc-tcr-epitope-binding-affinity.def

# apptainer build tdc-tcr-epitope-binding-affinity.sif tdc-tcr-epitope-binding-affinity.def

Bootstrap: docker
From:  continuumio/miniconda3@sha256:58b1c7df8d69655ffec017ede784a075e3c2e9feff0fc50ef65300fc75aa45ae

%files
    # Copy files to image
    requirements* .
    environment.yml .
    README.md .

%post

    export PIP_ROOT_USER_ACTION=ignore

    # Conda create environment and activate it.
    conda update --name base --channel defaults conda
    conda env update --name base --file environment.yml --prune && conda clean -afy


%labels
    Author Tony Reina
    Version v0.1

%help
    This is the definition file for creating an apptainer
    for the TDC TCR-Epitope Binding Affinity Prediction Task.
    https://tdcommons.ai/multi_pred_tasks/tcrepitope/