diff --git a/singularity/run_pipeline.def b/singularity/run_pipeline.def index d7a5ac581eff30f36275f14fda3c71da0b46ae27..fe6710d44e1cbf2c9dd4c71d5bc524e62edab057 100644 --- a/singularity/run_pipeline.def +++ b/singularity/run_pipeline.def @@ -13,16 +13,14 @@ From:workflows_base.sif #git clone --recurse-submodules https://gitlab+deploy-token-75:sakyTxfe-PxPHDwqsoGm@gitlab.pasteur.fr/bli/bioinfo_utils.git git clone https://gitlab+deploy-token-75:sakyTxfe-PxPHDwqsoGm@gitlab.pasteur.fr/bli/bioinfo_utils.git cd bioinfo_utils + WORKFLOWS_VERSION=$(git log | head -1 | cut -d " " -f2) pip install -r requirements.txt - # Recording program versions - for prog in bedops bedtools bowtie2 cutadapt hisat2 parallel samtools - do - echo "# ${prog}" >> /usr/local/share/doc/program_versions.txt - eval "${prog} --version" >> /usr/local/share/doc/program_versions.txt - done - prog="featureCounts" + prog="Python packages" echo "# ${prog}" >> /usr/local/share/doc/program_versions.txt - eval "${prog} -v" 2>> /usr/local/share/doc/program_versions.txt + pip freeze >> /usr/local/share/doc/program_versions.txt + prog="Workflows" + echo "# ${prog}" >> /usr/local/share/doc/program_versions.txt + echo "${WORKFLOWS_VERSION}" >> /usr/local/share/doc/program_versions.txt %environment export LC_ALL=C diff --git a/singularity/workflows_base.def b/singularity/workflows_base.def index c1221f655d7a1b66c996c5f5e06e1e022d745879..a0ce6d423cf9fd5e488904572cea2d5011c9832e 100644 --- a/singularity/workflows_base.def +++ b/singularity/workflows_base.def @@ -16,6 +16,7 @@ Stage: build-haskell cd /usr/local/src git clone https://gitlab+deploy-token-75:sakyTxfe-PxPHDwqsoGm@gitlab.pasteur.fr/bli/bioinfo_utils.git cd bioinfo_utils + HASKELL_TOOLS_VERSION=$(git log | head -1 | cut -d " " -f2) git submodule update --init --remote --merge # Note that currently only remove-duplicates-from-sorted-fastq # and trim-t-tail-from-fastq are copied to the next stage @@ -24,6 +25,8 @@ Stage: build-haskell do (cd ${dir} && grep "local" install.sh && ./install.sh) done + echo "# Haskell tools" >> /usr/local/share/doc/program_versions.txt + echo "${HASKELL_TOOLS_VERSION}" >> /usr/local/share/doc/program_versions.txt Bootstrap:docker From:python:3.7-buster @@ -31,6 +34,7 @@ From:python:3.7-buster %files from build-haskell /usr/local/bin/remove-duplicates-from-sorted-fastq /usr/local/bin/trim-t-tail-from-fastq + /usr/local/share/doc/program_versions.txt %post apt-get -y update @@ -41,6 +45,16 @@ From:python:3.7-buster # run_pipeline.sh (and maybe other tools) needs bc apt-get -y install bc rsync apt-get -y install bedops bedtools bowtie2 cutadapt subread hisat2 parallel samtools + # Recording program versions + for prog in bedops bedtools bowtie2 cutadapt hisat2 parallel samtools + do + echo "# ${prog}" >> /usr/local/share/doc/program_versions.txt + eval "${prog} --version" >> /usr/local/share/doc/program_versions.txt + done + # subread provides featureCounts + prog="featureCounts" + echo "# ${prog}" >> /usr/local/share/doc/program_versions.txt + eval "${prog} -v" 2>> /usr/local/share/doc/program_versions.txt # Some programs are not provided by debian # mkdir -p /usr/local/src ##################### @@ -49,9 +63,13 @@ From:python:3.7-buster cd /usr/local/src git clone https://github.com/lh3/bioawk.git cd bioawk + BIOAWK_VERSION=$(git log | head -1 | cut -d " " -f2) apt install -y byacc make ln -s /usr/local/src/bioawk/bioawk /usr/local/bin/. + prog="bioawk" + echo "# ${prog}" >> /usr/local/share/doc/program_versions.txt + echo "${BIOAWK_VERSION}" >> /usr/local/share/doc/program_versions.txt ########################## # Installing fastq-tools # ########################## @@ -62,6 +80,10 @@ From:python:3.7-buster ./configure make make install + # fastq-tools provides fastq-sort + prog="fastq-sort" + echo "# ${prog}" >> /usr/local/share/doc/program_versions.txt + eval "${prog} --version" >> /usr/local/share/doc/program_versions.txt ######################### # Installing kent utils # ######################### @@ -69,15 +91,24 @@ From:python:3.7-buster #mkdir UCSC-tools #cd UCSC-tools rsync -azvP rsync://hgdownload.soe.ucsc.edu/genome/admin/exe/linux.x86_64/bedGraphToBigWig /usr/local/bin/. + prog="bedGraphToBigWig" + echo "# ${prog}" >> /usr/local/share/doc/program_versions.txt + eval "${prog}" 2>> /usr/local/share/doc/program_versions.txt # It is possible to test whether the R install is already OK deb_source="deb http://cran.irsn.fr/bin/linux/debian buster-cran35/" echo ${deb_source} >> /etc/apt/sources.list.d/cran.list apt-key adv --keyserver keys.gnupg.net --recv-key 'E19F5F87128899B192B1A2C2AD5F960A256A04AF' apt-get -y update apt-get -y install r-base-core r-base-dev + prog="R" + echo "# ${prog}" >> /usr/local/share/doc/program_versions.txt + eval "${prog} --version" >> /usr/local/share/doc/program_versions.txt R -e 'install.packages("BiocManager")' R -e 'BiocManager::install(ask=FALSE)' R -e 'BiocManager::install(c("docopt", "DESeq2"), ask=FALSE)' + prog="DESeq2" + echo "# ${prog}" >> /usr/local/share/doc/program_versions.txt + R -q -e 'packageVersion("DESeq2")' >> /usr/local/share/doc/program_versions.txt # To use the "local" python, not the system one. export PATH="/usr/local/bin":$PATH