diff --git a/.github/workflows/build.yml b/.github/workflows/build.yml deleted file mode 100644 index 051ef67c..00000000 --- a/.github/workflows/build.yml +++ /dev/null @@ -1,19 +0,0 @@ -name: Build - -on: [push] - -jobs: - build: - runs-on: self-hosted - steps: - - uses: actions/checkout@v4 - - uses: astral-sh/setup-uv@v3 - - name: Install dependencies - run: uv sync - - name: Build figures - run: make all - - name: Upload files - uses: actions/upload-artifact@v4 - with: - name: files - path: output diff --git a/.github/workflows/test.yml b/.github/workflows/test.yml index c21015f6..4392fb36 100644 --- a/.github/workflows/test.yml +++ b/.github/workflows/test.yml @@ -4,7 +4,7 @@ on: [push] jobs: build: - runs-on: self-hosted + runs-on: ubuntu-latest steps: - uses: actions/checkout@v4 - uses: astral-sh/setup-uv@v3 @@ -15,11 +15,4 @@ jobs: - name: Typecheck run: make typecheck - name: Test with pytest - run: make coverage.xml - - name: Upload coverage to Codecov - uses: codecov/codecov-action@v3 - with: - file: ./coverage.xml - flags: unittests - name: codecov-umbrella - fail_ci_if_error: true + run: make coverage diff --git a/README.md b/README.md index 4e28805d..cdefc51a 100644 --- a/README.md +++ b/README.md @@ -1,10 +1,13 @@ # Co-clustering for mass spectrometry peptide analysis -![Build](https://github.com/meyer-lab/resistance-MS/workflows/Build/badge.svg) -![Test](https://github.com/meyer-lab/resistance-MS/workflows/Test/badge.svg) - Clusters peptides based on both sequence similarity and phosphorylation signal across samples. +This repository contains the implementation of dual data and motif clustering (DDMC), described in: + +> Creixell M, Meyer AS. [Dual data and motif clustering improves the modeling and interpretation of phosphoproteomic data](https://pubmed.ncbi.nlm.nih.gov/35360705/). *Cell Rep Methods*. 2022 Feb 28;2(2):100167. doi: [10.1016/j.crmeth.2022.100167](https://doi.org/10.1016/j.crmeth.2022.100167) + +**Abstract:** Cell signaling is orchestrated in part through a network of protein kinases and phosphatases. Dysregulation of kinase signaling is widespread in diseases such as cancer and is readily targetable through inhibitors. Mass spectrometry-based analysis can provide a global view of kinase regulation, but mining these data is complicated by its stochastic coverage of the proteome, measurement of substrates rather than kinases, and the scale of the data. Here, we implement a dual data and motif clustering (DDMC) strategy that simultaneously clusters peptides into similarly regulated groups based on their variation and their sequence profile. We show that this can help to identify putative upstream kinases and supply more robust clustering. We apply this clustering to clinical proteomic profiling of lung cancer and identify conserved proteomic signatures of tumorigenicity, genetic mutations, and immune infiltration. We propose that DDMC provides a general and flexible clustering strategy for the analysis of phosphoproteomic data. + ## Usage diff --git a/makefile b/makefile index 866add3f..0c7299d4 100644 --- a/makefile +++ b/makefile @@ -13,8 +13,8 @@ testprofile: uv run python3 -m cProfile -o profile -m pytest -s -v -x gprof2dot -f pstats --node-thres=5.0 profile | dot -Tsvg -o profile.svg -coverage.xml: - uv run pytest --cov=ddmc --cov-report=xml +coverage: + uv run pytest --cov=ddmc --cov-report=term clean: rm -rf *.pdf pylint.log output diff --git a/pyproject.toml b/pyproject.toml index 770e564d..0d92e711 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -5,13 +5,13 @@ description = "" authors = [{ name = "Aaron Meyer", email = "git@asmlab.org" }] license = "MIT" readme = "README.md" -requires-python = ">=3.11,<3.13" +requires-python = ">=3.12" dependencies = [ "scipy>=1.16", "matplotlib>=3.10", "seaborn>=0.13.2", "svgutils>=0.3.4", - "pandas>=2.2.3", + "pandas>=3", "panflute>=2.3.1", 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