experanto/apptainer.def at main · BitForge95/experanto · GitHub

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Bootstrap: docker
From: nvcr.io/nvidia/pytorch:25.03-py3

%environment
    export DEBIAN_FRONTEND=noninteractive
    export JUPYTER_ENABLE_LAB=yes

%post
    apt-get update && apt-get install -y --no-install-recommends \
        build-essential \
        ca-certificates \
        curl \
        wget \
        git \
        python3 \
        python3-pip \
        python3-dev \
        python3-venv \
        && rm -rf /var/lib/apt/lists/*

    python3 -m pip install --upgrade pip
    pip install scipy>=1.13.1 \
            jaxtyping>=0.2.30 \
            plotly>=5.22.0 \
            pandas \
            rootutils>=1.0.7 \
            optree>=0.13.0 \
            hydra-core==1.3.2 \
            omegaconf==2.3.0 \
            opencv_python==4.11.0.86 \
            PyYAML==6.0.2 \
            jupyterlab \
            tqdm

%labels
    Author Goirik
    Description "Apptainer container for JupyterLab with PyTorch"

%files
    . /project