From ed58b36c7092deb5f7d5c0300fce1f3ca3d90a91 Mon Sep 17 00:00:00 2001 From: Olivier Filangi Date: Tue, 3 May 2022 16:15:03 +0200 Subject: [PATCH] Develop (#41) * Develop backup (#34) * udpate Readme and plugin gpg https://github.com/jodersky/sbt-gpg * downgrade gpg to 0.2.1. 0.2.2 not available ! * remove tagret directory fro repo * remove tagret directory fro repo * update Readme * fix jar publication * covered code for commands * update readme with badge * remove script * change galaxy recipe directory * remove temp file * minor fix for resume * add planemo test * add planemo test * add planemo test * add planemo test * add planemo test * planemo test only master/main/develop * lint planemo + conda test version * lint planemo + conda test version * lint planemo + conda test version * update fix meta.yml * remove conda recipe * clean repo * add sbt-release (#16) * Sbt release (#18) * add sbt-release * valid pom generation * Dockerfile (#20) * target directory for assembly * add dockerized task * add dockerfile * update gitignore * use directory docker * update docker management * fix outputdir assembly * update docker config * remove debug config * Dockerfile (#22) * target directory for assembly * add dockerized task * add dockerfile * update gitignore * use directory docker * update docker management * fix outputdir assembly * update docker config * remove debug config * remove coverage enable * fix dockerfile implementation to run process inside galaxy tools * Uplc tqd to isocor 24 (#26) * update Readme * add MassLynx parser / tests * replace strip with trim * increase coverage. manage bad line def inside array compound * fix coverage * fix coverage * add command/output object and tests * save notes * add galaxy config tools - gcms2isocor openlabcds2csv masslynx2isocor (#27) * add galaxy config tools - gcms2isocor openlabcds2csv masslynx2isocor * fix doc/name bin * downgrade profile galaxy version * fx test masslynx * inverse sample/metabolite in the input isocor file. (#35) * fix (#36) * fix * save * fix coverage * fix typo. increase test precision * increase limit coverage test to 97% ! * fix masslynx2isocor. 0.1.7 * add 0.1.7 jar * update circleci config with planemo conf (#38) * update circleci config with planemo conf * install planemo * fix option planemo * remove docker exemple from planemo test * add jar * decrease coverage mandatory * test artefacts * up * coverage * update with lint * update * Isotopic mass configuration 39 (#40) * features: new method getNumberElementFromFormula to manage isotopic metabolites * save dev * update 0.1.8 * update galaxy tool masslynx2isocor * fix: repair/read formula from isocor Metabolites.dat. close #39 * update galaxy tool masslynx2isocor --- .circleci/config.yml | 66 +- build.sbt | 14 +- galaxy/docker_env_exemple/gcms2isocor.xml | 4 +- .../P2M2WorkflowsTools-assembly-0.1.4.jar | Bin 6142637 -> 0 bytes galaxy/gcms2isocor/gcms2isocor.xml | 2 +- ...0.1.7.jar => P2M2Tools-assembly-0.1.8.jar} | Bin 6191527 -> 6200428 bytes galaxy/masslynx2isocor/masslynx2isocor.xml | 14 +- .../masslynx2isocor/test-data/Metabolites.dat | 25 + ...{input_isocor.tsv => isocor_input_13C.tsv} | 814 ----- .../test-data/isocor_input_15N.tsv | 2845 +++++++++++++++++ project/build.properties | 2 +- .../p2m2/command/MassLynx2IsocorCommand.scala | 86 +- .../MassLynxOutput2IsocorInput.scala | 90 +- .../p2m2/tools/format/input/InputIsocor.scala | 9 +- src/test/resources/MassLynx/Metabolites.dat | 25 + .../resources/MassLynx/Metabolites_test.dat | 2 + .../command/MassLynx2IsocorCommandTest.scala | 76 +- .../MassLynxOutput2IsocorInputTest.scala | 75 +- 18 files changed, 3217 insertions(+), 932 deletions(-) delete mode 100644 galaxy/gcms2isocor/P2M2WorkflowsTools-assembly-0.1.4.jar rename galaxy/masslynx2isocor/{P2M2Tools-assembly-0.1.7.jar => P2M2Tools-assembly-0.1.8.jar} (96%) create mode 100644 galaxy/masslynx2isocor/test-data/Metabolites.dat rename galaxy/masslynx2isocor/test-data/{input_isocor.tsv => isocor_input_13C.tsv} (88%) create mode 100644 galaxy/masslynx2isocor/test-data/isocor_input_15N.tsv create mode 100644 src/test/resources/MassLynx/Metabolites.dat create mode 100644 src/test/resources/MassLynx/Metabolites_test.dat diff --git a/.circleci/config.yml b/.circleci/config.yml index 413a887..1b4ab7b 100644 --- a/.circleci/config.yml +++ b/.circleci/config.yml @@ -17,23 +17,33 @@ # version: 2.1 orbs: - node: circleci/node@4.7.0 + node: circleci/node@5.0.2 workflows: compile-workflow: jobs: - compile: context: - DOCKER_CONTEXT - - test_and_coverage_jvm: requires: - compile context: - DOCKER_CONTEXT - + - planemo_stage: + context: + - DOCKER_CONTEXT + filters: + tags: + ignore: /.*/ + branches: + only: + - develop + - main + - master - publish_snapshot: requires: - test_and_coverage_jvm + - planemo_stage context: - DOCKER_CONTEXT - CREDENTIAL_CONTEXT @@ -89,7 +99,15 @@ executors: auth: username: ${DOCKER_USER} password: ${DOCKER_PASS} - + + python: + working_directory: ~/planemo + docker: + - image: cimg/python:3.10.1 # primary container for the build job + auth: + username: ${DOCKER_USER} + password: ${DOCKER_PASS} + docker-publisher: docker: - image: circleci/buildpack-deps:stretch @@ -141,7 +159,45 @@ jobs: - store_artifacts: path: target/test-reports - + + planemo_stage: + executor: python + steps: + - checkout + - setup_remote_docker + - restore_cache: + keys: + - v1-dependencies-{{ checksum "build.sbt" }} + # fallback to using the latest cache if no exact match is found + - v1-dependencies- + - run: + name: Test P2M2 tools for Galaxy + command: | + cd galaxy + pip install planemo + for directory in $(ls -d ls -d */ | awk '!/docker/ {print $0}') + do + echo " == $directory == " + pushd $directory + planemo l --fail_level error + popd + done + - run: + name: Run on fail status + command: | + mkdir -p /tmp/html_reports + cp $(find ./galaxy/ -name *.html -type f) /tmp/html_reports/ + mkdir -p /tmp/json_reports + cp $(find ./galaxy/ -name *.json -type f) /tmp/json_reports/ + when: on_fail + + - store_artifacts: + path: /tmp/html_reports/tool_test_output.html + destination: artifacts-planemo-reports-html + - store_artifacts: + path: /tmp/json_reports/tool_test_output.json + destination: artifacts-planemo-reports-json + publish_snapshot: executor: openjdk steps: diff --git a/build.sbt b/build.sbt index ac3fe3b..2fb58e5 100644 --- a/build.sbt +++ b/build.sbt @@ -15,19 +15,23 @@ scmInfo := Some( ) versionScheme := Some("early-semver") - -val static_version = "0.1.7" +val static_version = "0.1.8" val version_build = scala.util.Properties.envOrElse("PROG_VERSION", static_version ) version := version_build -libraryDependencies += "com.lihaoyi" %% "utest" % "0.7.10" % "test" +libraryDependencies += "com.lihaoyi" %% "utest" % "0.7.11" % "test" libraryDependencies += "com.github.scopt" %% "scopt" % "4.0.1" // Coverage -coverageMinimumStmtTotal := 98 -coverageFailOnMinimum := false +coverageMinimumStmtTotal := 97 +coverageMinimumBranchTotal := 93 +coverageMinimumStmtPerPackage := 93 +coverageMinimumBranchPerPackage := 93 +coverageMinimumStmtPerFile := 93 +coverageMinimumBranchPerFile := 93 +coverageFailOnMinimum := true coverageHighlighting := true // Publication diff --git a/galaxy/docker_env_exemple/gcms2isocor.xml b/galaxy/docker_env_exemple/gcms2isocor.xml index 20e2a12..51f9403 100644 --- a/galaxy/docker_env_exemple/gcms2isocor.xml +++ b/galaxy/docker_env_exemple/gcms2isocor.xml @@ -1,9 +1,9 @@ - inraep2m2/p2m2tools:0.1.5 + inraep2m2/p2m2tools:0.1.7 X#DSS(^RDowM0X2v*wGouFu(8mC z62zHR$=41il5NaFENaW9Tv5Gu00vT!hJakel=yV}ttAaG(C^fdZ#i~M)=YmOlKz=!XlvtQ z?BHblC$otEEW!@p;P^*A(VzKFwzgJ(GM(aoLpQN?um(8&VI1iG11aVRIg`3L@Y$}#%`@Sh4e7@Pb72mcR&zj1#}j6Yz}{x7UGz|g_=PxJ1d zasB^_|1XNU&F{o-1Nc*1|BGtQHcsZ&e~L-ef2#Ih*uTb-;}6FCbATM(|75{GJ@gmO z&cW8u*zr&Je|pH-$^1{|q5MPTzX5-Tpp%2`e?Tw;IGUN;nEt`Ue-6suuJAiz4F3nl z-){)Ec7Kn8f4`9WD>uqW3X94qi|YSvCeT`$8#n+Q+-aHU7@6tVHnp@J*N4!2e%7ow z6f2v97iY1U;~at6qB8=~uSiz~Z2 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