feat: dockerfile cleanup, Makefile expansion

Makefile

@@ -1,4 +1,4 @@
-.PHONY: clean_local install lint test doc_api doc_html clean_doc
+.PHONY: clean_local build install lint test doc_api doc_html clean_doc
 
 clean_local:
 	@find . -name "*.pyc" -type f -delete
@@ -8,17 +8,20 @@ clean_local:
 	@ruff clean
 	@rm -rf .mypy_cache .pytest_cache build dist nxbench.egg-info htmlcov .benchmarks env
 
+build:
+	@docker-compose build
+
 install: clean_local
-	pip uninstall nxbench -y
-	pip install -e .
+	@pip uninstall nxbench -y
+	@pip install -e .
 
 lint: clean_local
-	isort .
-	ruff format .
-	black .
+	@isort .
+	@ruff format .
+	@black .
 
 test: clean_local
-	pytest -vvv --disable-warnings --cov=nxbench --cov-report=xml --cov-report=html --cov-report=term-missing
+	@pytest -vvv --disable-warnings --cov=nxbench --cov-report=xml --cov-report=html --cov-report=term-missing
 
 SPHINXOPTS    =
 SPHINXBUILD   = sphinx-build

docker/Dockerfile

@@ -6,6 +6,10 @@ ENV CUDA_HOME=/usr/local/cuda
 ENV PATH=${CUDA_HOME}/bin:${PATH}
 ENV LD_LIBRARY_PATH=${CUDA_HOME}/lib64:${LD_LIBRARY_PATH}
 
+WORKDIR /app
+
+COPY . /app/
+
 RUN apt-get update && apt-get install -y \
     build-essential \
     ca-certificates \
@@ -18,17 +22,13 @@ RUN apt-get update && apt-get install -y \
     && apt-get clean \
     && apt-get purge -y \
     && rm -rf /var/lib/{apt,dpkg,cache,log}/ \
-    && rm -rf /tmp/* /var/tmp/*
-
-WORKDIR /app
-
-COPY . /app/
-
-RUN pip install --no-cache-dir -e .[cuda,scrape] \
+    && rm -rf /tmp/* /var/tmp/* \
+    && pip install --no-cache-dir -e .[cuda] \
     nx-parallel \
     python-graphblas \
     ipython \
-    && mkdir -p ~/.nxbench/data
+    && mkdir -p ~/.nxbench/data \
+    && rm -rf /root/.cache/pip
 
 ENV NXBENCH_HOME=/root/.nxbench
 ENV NXBENCH_CONFIG_FILE=/app/configs/example.yaml
@@ -38,4 +38,4 @@ CMD ["nxbench"]
 LABEL maintainer="Derek Alexander <[email protected]>"
 LABEL description="Container image for nxbench graph algorithm benchmarking suite"
 LABEL version="0.1.0"
-LABEL org.opencontainers.image.source="https://github.com/dpys/nxbench"
+LABEL org.opencontainers.image.source="https://github.com/dpys/nxbench"

pyproject.toml

@@ -190,6 +190,7 @@ exclude = [
     ".venv",
     "__pypackages__",
     "_build",
+    "docker/**",
     "buck-out",
     "build",
     "dist",