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add back transformer engine install #658

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Jan 29, 2025
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30 changes: 13 additions & 17 deletions Dockerfile
Original file line number Diff line number Diff line change
Expand Up @@ -16,12 +16,6 @@ RUN rustup set profile minimal && \

FROM ${BASE_IMAGE} AS bionemo2-base

# Install NeMo dependencies.
WORKDIR /build

ARG MAX_JOBS=4
ENV MAX_JOBS=${MAX_JOBS}

# Install core apt packages.
RUN --mount=type=cache,id=apt-cache,target=/var/cache/apt,sharing=locked \
--mount=type=cache,id=apt-lib,target=/var/lib/apt,sharing=locked \
Expand All @@ -34,13 +28,17 @@ apt-get install -qyy \
git \
curl \
pre-commit \
sudo
sudo \
gnupg
apt-get upgrade -qyy \
rsync
rm -rf /tmp/* /var/tmp/*
EOF

RUN apt-get install -y gnupg
ARG TE_COMMIT=2215fa5c7557b66034068816020f9f611019e457
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RUN NVTE_FRAMEWORK=pytorch NVTE_WITH_USERBUFFERS=1 MPI_HOME=/usr/local/mpi \
pip --disable-pip-version-check --no-cache-dir install \
git+https://github.com/NVIDIA/TransformerEngine.git@${TE_COMMIT}

# Check the nemo dependency for causal conv1d and make sure this checkout
# tag matches. If not, update the tag in the following line.
Expand All @@ -57,9 +55,7 @@ RUN pip install nemo_run@git+https://github.com/NVIDIA/NeMo-Run.git@${NEMU_RUN_T

RUN mkdir -p /workspace/bionemo2/

# Delete the temporary /build directory.
WORKDIR /workspace
RUN rm -rf /build

# Addressing Security Scan Vulnerabilities
RUN rm -rf /opt/pytorch/pytorch/third_party/onnx
Expand All @@ -79,7 +75,7 @@ ENV UV_LINK_MODE=copy \
# Install the bionemo-geometric requirements ahead of copying over the rest of the repo, so that we can cache their
# installation. These involve building some torch extensions, so they can take a while to install.
RUN --mount=type=bind,source=./sub-packages/bionemo-geometric/requirements.txt,target=/requirements-pyg.txt \
--mount=type=cache,target=/root/.cache \
--mount=type=cache,target=/root/.cache \
uv pip install --no-build-isolation -r /requirements-pyg.txt

COPY --from=rust-env /usr/local/cargo /usr/local/cargo
Expand All @@ -99,9 +95,9 @@ COPY ./sub-packages /workspace/bionemo2/sub-packages
# Includes a hack to install tensorstore 0.1.45, which doesn't distribute a pypi wheel for python 3.12, and the metadata
# in the source distribution doesn't match the expected pypi version.
RUN --mount=type=bind,source=./.git,target=./.git \
--mount=type=bind,source=./requirements-test.txt,target=/requirements-test.txt \
--mount=type=bind,source=./requirements-cve.txt,target=/requirements-cve.txt \
--mount=type=cache,target=/root/.cache <<EOF
--mount=type=bind,source=./requirements-test.txt,target=/requirements-test.txt \
--mount=type=bind,source=./requirements-cve.txt,target=/requirements-cve.txt \
--mount=type=cache,target=/root/.cache <<EOF
set -eo pipefail

uv pip install maturin --no-build-isolation
Expand All @@ -124,8 +120,8 @@ EOF
FROM ${BASE_IMAGE} AS dev

RUN --mount=type=cache,id=apt-cache,target=/var/cache/apt,sharing=locked \
--mount=type=cache,id=apt-lib,target=/var/lib/apt,sharing=locked \
<<EOF
--mount=type=cache,id=apt-lib,target=/var/lib/apt,sharing=locked \
<<EOF
set -eo pipefail
apt-get update -qy
apt-get install -qyy \
Expand Down Expand Up @@ -168,7 +164,7 @@ ENV PATH="/usr/local/cargo/bin:/usr/local/rustup/bin:${PATH}"
ENV RUSTUP_HOME="/usr/local/rustup"

RUN --mount=type=bind,source=./requirements-dev.txt,target=/workspace/bionemo2/requirements-dev.txt \
--mount=type=cache,target=/root/.cache <<EOF
--mount=type=cache,target=/root/.cache <<EOF
set -eo pipefail
uv pip install -r /workspace/bionemo2/requirements-dev.txt
rm -rf /tmp/*
Expand Down
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