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Change pdb no H error to warning. (#910) #1356

Change pdb no H error to warning. (#910)

Change pdb no H error to warning. (#910) #1356

Workflow file for this run

name: CI
on: [push, pull_request]
env:
BUILD_DIR: _build
jobs:
gcc-meson-build:
runs-on: ${{ matrix.os }}
strategy:
fail-fast: false
matrix:
os: [macos-latest, ubuntu-latest]
fc: [gfortran-11]
cc: [gcc-11]
include:
- os: ubuntu-latest
fc: gfortran-9
cc: gcc-9
- os: ubuntu-latest
fc: gfortran-10
cc: gcc-10
steps:
- name: Checkout code
uses: actions/checkout@v3
- name: Setup Python
uses: actions/setup-python@v1
with:
python-version: 3.x
- name: Install OpenBLAS (OSX)
if: ${{ contains(matrix.os, 'macos') }}
run: |
brew install openblas
echo "PKG_CONFIG_PATH=/usr/local/opt/openblas/lib/pkgconfig" >> $GITHUB_ENV
- name: Install meson
run: pip3 install meson==0.62.0 ninja cmake
- name: Configure build
run: >-
meson setup ${{ env.BUILD_DIR }}
--buildtype=debug
--warnlevel=0
-Db_coverage=true
${{ env.MESON_ARGS }}
env:
FC: ${{ matrix.fc }}
CC: ${{ matrix.cc }}
MESON_ARGS: ${{ contains(matrix.os, 'macos') && '-Dlapack=openblas' || '-Dlapack=netlib' }}
- name: Build project
run: meson compile -C ${{ env.BUILD_DIR }}
- name: Run unit tests
run: meson test -C ${{ env.BUILD_DIR }} --print-errorlogs --no-rebuild -t 120 --suite xtb
env:
OMP_NUM_THREADS: 2,1
- name: Upload coverage report
run: bash <(curl -s https://codecov.io/bash)
gcc-cmake-build:
runs-on: ${{ matrix.os }}
strategy:
fail-fast: false
matrix:
os: [ubuntu-latest]
fc: [gfortran-10]
cc: [gcc-10]
steps:
- name: Checkout code
uses: actions/checkout@v3
- name: Setup Python
uses: actions/setup-python@v4
with:
python-version: 3.x
- name: Install CMake
run: pip3 install ninja cmake==3.26.4
- name: Configure build
run: cmake -B ${{ env.BUILD_DIR }} -G Ninja
env:
FC: ${{ matrix.fc }}
CC: ${{ matrix.cc }}
- name: Build project
run: cmake --build ${{ env.BUILD_DIR }}
- name: Run unit tests
run: ctest --parallel --output-on-failure -R 'xtb/*'
working-directory: ${{ env.BUILD_DIR }}
env:
OMP_NUM_THREADS: 2,1
xtb-lightweight-meson-build:
runs-on: ${{ matrix.os }}
strategy:
fail-fast: false
matrix:
os: [ubuntu-latest]
fc: [gfortran-11]
cc: [gcc-11]
steps:
- name: Checkout code
uses: actions/checkout@v3
- name: Setup Python
uses: actions/setup-python@v1
with:
python-version: 3.x
- name: Install meson
run: pip3 install meson==0.62.0 ninja cmake
- name: Configure build
run: >-
meson setup ${{ env.BUILD_DIR }}
--buildtype=debug
--warnlevel=0
${{ env.MESON_ARGS }}
env:
FC: ${{ matrix.fc }}
CC: ${{ matrix.cc }}
MESON_ARGS: ${{ '-Dlapack=netlib -Dtblite=disabled -Dcpcmx=disabled' }}
- name: Build project
run: meson compile -C ${{ env.BUILD_DIR }}
- name: Run unit tests
run: meson test -C ${{ env.BUILD_DIR }} --print-errorlogs --no-rebuild -t 120 --suite xtb
env:
OMP_NUM_THREADS: 2,1
xtb-lightweight-cmake-build:
runs-on: ${{ matrix.os }}
strategy:
fail-fast: false
matrix:
os: [ubuntu-latest]
fc: [gfortran-10]
cc: [gcc-10]
steps:
- name: Checkout code
uses: actions/checkout@v3
- name: Setup Python
uses: actions/setup-python@v4
with:
python-version: 3.x
- name: Install CMake
run: pip3 install ninja cmake==3.26.4
- name: Configure build
run: cmake -B ${{ env.BUILD_DIR }} -DWITH_CPCMX=false -DWITH_TBLITE=false -G Ninja
env:
FC: ${{ matrix.fc }}
CC: ${{ matrix.cc }}
- name: Build project
run: cmake --build ${{ env.BUILD_DIR }}
- name: Run unit tests
run: ctest --parallel --output-on-failure -R 'xtb/*'
working-directory: ${{ env.BUILD_DIR }}
env:
OMP_NUM_THREADS: 2,1
# Test native MinGW Windows build
mingw-meson-build:
runs-on: windows-latest
strategy:
fail-fast: false
matrix:
include: [
{ msystem: MINGW64, arch: x86_64 },
# { msystem: MINGW32, arch: i686 }
]
defaults:
run:
shell: msys2 {0}
steps:
- name: Checkout code
uses: actions/checkout@v3
- name: Setup MSYS2 toolchain
uses: msys2/setup-msys2@v2
with:
msystem: ${{ matrix.msystem }}
update: false
install: >-
git
mingw-w64-${{ matrix.arch }}-gcc-fortran
mingw-w64-${{ matrix.arch }}-openblas
mingw-w64-${{ matrix.arch }}-lapack
mingw-w64-${{ matrix.arch }}-python
mingw-w64-${{ matrix.arch }}-python-pip
mingw-w64-${{ matrix.arch }}-meson
mingw-w64-${{ matrix.arch }}-ninja
- name: Configure build
run: meson setup ${{ env.BUILD_DIR }} -Dlapack=netlib --warnlevel=0
env:
FC: gfortran
CC: gcc
- name: Build project
run: meson compile -C ${{ env.BUILD_DIR }}
- name: Run unit tests
run: meson test -C ${{ env.BUILD_DIR }} --print-errorlogs --no-rebuild -t 120 --suite xtb
env:
OMP_NUM_THREADS: 1
intel-meson-build:
runs-on: ${{ matrix.os }}
strategy:
fail-fast: false
matrix:
os: [ubuntu-20.04]
fc: [ifort]
cc: [icc]
env:
FC: ${{ matrix.fc }}
CC: ${{ matrix.cc }}
APT_PACKAGES: >-
intel-oneapi-compiler-fortran
intel-oneapi-compiler-dpcpp-cpp-and-cpp-classic
intel-oneapi-mkl
intel-oneapi-mkl-devel
asciidoctor
steps:
- name: Checkout code
uses: actions/checkout@v3
- name: Setup Python
uses: actions/setup-python@v1
with:
python-version: 3.x
- run: pip3 install meson ninja --user
- name: Add Intel repository
if: contains(matrix.os, 'ubuntu')
run: |
wget https://apt.repos.intel.com/intel-gpg-keys/GPG-PUB-KEY-INTEL-SW-PRODUCTS-2023.PUB
sudo apt-key add GPG-PUB-KEY-INTEL-SW-PRODUCTS-2023.PUB
rm GPG-PUB-KEY-INTEL-SW-PRODUCTS-2023.PUB
echo "deb https://apt.repos.intel.com/oneapi all main" | sudo tee /etc/apt/sources.list.d/oneAPI.list
sudo apt-get update
- name: Install Intel oneAPI compiler
if: contains(matrix.os, 'ubuntu')
run: |
sudo apt-get install ${APT_PACKAGES}
source /opt/intel/oneapi/setvars.sh
source /opt/intel/oneapi/compiler/2024.0/env/vars.sh
printenv >> $GITHUB_ENV
- name: Configure meson build
run: >-
meson setup ${{ env.BUILD_DIR }}
--prefix=/ --libdir=lib
-Dfortran_link_args="-lifcoremt -static"
-Ddefault_library=static
-Dlapack=mkl
- name: Build project
run: ninja -C ${{ env.BUILD_DIR }}
- name: Run unit tests
run: >-
meson test -C ${{ env.BUILD_DIR }}
--print-errorlogs
--num-processes 1
--no-rebuild
--suite xtb
-t 120
env:
OMP_NUM_THREADS: 2,1
- name: Install package
run: |
meson install -C ${{ env.BUILD_DIR }} --no-rebuild
tar cJvf xtb-bleed.tar.xz xtb-bleed
env:
DESTDIR: ${{ env.PWD }}/xtb-bleed
- name: Upload binary
if: github.event_name == 'push'
uses: actions/upload-artifact@v2
with:
name: xtb-bleed.tar.xz
path: xtb-bleed.tar.xz
# Inspired from https://github.com/endless-sky/endless-sky
continuous-delivery:
if: github.event_name == 'push'
runs-on: ubuntu-latest
needs:
- intel-meson-build
env:
GITHUB_TOKEN: ${{ secrets.GITHUB_TOKEN }}
RELEASE_TAG: bleed
OUTPUT_INTEL: xtb-bleed.tar.xz
steps:
- uses: actions/checkout@v3
- name: Install github-release
run: |
go install github.com/github-release/github-release@latest
echo "GOPATH=$(go env GOPATH)" >> $GITHUB_ENV
echo "$(go env GOPATH)/bin" >> $GITHUB_PATH
- name: Set environment variables
run: |
echo "GITHUB_USER=$( echo ${{ github.repository }} | cut -d/ -f1 )" >> $GITHUB_ENV
echo "GITHUB_REPO=$( echo ${{ github.repository }} | cut -d/ -f2 )" >> $GITHUB_ENV
- name: Move/Create continuous tag
run: |
git tag --force ${{ env.RELEASE_TAG }} ${{ github.sha }}
git push --tags --force
- name: Get Time
run: echo "TIME=$(date -u '+%Y/%m/%d, %H:%M')" >> $GITHUB_ENV
- name: Check continuous release status
run: |
if ! github-release info -t ${{ env.RELEASE_TAG }} > /dev/null 2>&1; then
echo "RELEASE_COMMAND=release" >> $GITHUB_ENV
else
echo "RELEASE_COMMAND=edit" >> $GITHUB_ENV
fi
- name: Setup continuous release
run: >-
github-release ${{ env.RELEASE_COMMAND }}
--tag ${{ env.RELEASE_TAG }}
--name "Bleeding edge version"
--description "$DESCRIPTION"
--pre-release
env:
DESCRIPTION: |
Created on ${{ env.TIME }} UTC by @${{ github.actor }} with commit ${{ github.sha }}.
This is an automated distribution of the latest `xtb` version. This version is only minimally tested and may be unstable or even crash. Use with caution!
https://github.com/${{ github.repository }}/actions/runs/${{ github.run_id }}
- name: Download Artifacts
uses: actions/download-artifact@v2
with:
path: ${{ github.workspace }} # This will download all files
- name: Create SHA256 checksum
run: |
cd ${{ env.OUTPUT_INTEL }}
sha256sum ${{ env.OUTPUT_INTEL }} > sha256.txt
- name: Add ${{ env.OUTPUT_INTEL }} to release tag
run: >-
github-release upload
--tag ${{ env.RELEASE_TAG }}
--replace
--name ${{ env.OUTPUT_INTEL }}
--file ${{ env.OUTPUT_INTEL }}/${{ env.OUTPUT_INTEL }}
- name: Add SHA256 checksums to release tag
run: >-
github-release upload
--tag ${{ env.RELEASE_TAG }}
--replace
--name sha256.txt
--file ${{ env.OUTPUT_INTEL }}/sha256.txt