1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59
|
#!/bin/bash
# author: Ole Schuett
if (($# != 2)); then
echo "Usage: test_regtest_cmake.sh <PROFILE> <VERSION>"
exit 1
fi
PROFILE=$1
VERSION=$2
ulimit -c 0 # Disable core dumps as they can take a very long time to write.
# Check available shared memory - needed for MPI inter-process communication.
SHM_AVAIL=$(df --output=avail -m /dev/shm | tail -1)
if ((SHM_AVAIL < 1024)); then
echo "ERROR: Not enough shared memory. If you're running docker use --shm-size=1g."
exit 1
fi
# Compile CP2K.
./build_cp2k_cmake.sh "${PROFILE}" "${VERSION}" || exit 0
# Fake installation of data files.
mkdir -p ./share/cp2k
ln -s ../../data ./share/cp2k/data
# Extend stack size only for Intel compilers.
if "./build/bin/cp2k.${VERSION}" --version | grep -q "compiler: Intel"; then
ulimit -s unlimited # breaks address sanitizer
export OMP_STACKSIZE=64m
fi
# Improve code coverage on COSMA.
export COSMA_DIM_THRESHOLD=0
# Make OpenMPI happy.
export OMPI_MCA_plm_rsh_agent=/bin/false
export OMPI_ALLOW_RUN_AS_ROOT=1
export OMPI_ALLOW_RUN_AS_ROOT_CONFIRM=1
# Load Spack or Toolchain environment.
if [[ "${PROFILE}" =~ ^spack ]]; then
eval "$(spack env activate myenv --sh)"
elif [[ "${PROFILE}" =~ ^toolchain ]]; then
# shellcheck disable=SC1091
source /opt/cp2k-toolchain/install/setup
fi
# Run regtests.
echo -e "\n========== Running Regtests =========="
set -x
# shellcheck disable=SC2086
./tests/do_regtest.py ./build/bin/ ${VERSION} ${TESTOPTS}
exit 0 # Prevent CI from overwriting do_regtest's summary message.
#EOF
|