.gitlab-ci.yml

stages:
  - cudatest

cudatest:
  stage: cudatest
  tags:
  - cuda
  script:
  - mkdir -p build_cuda
  - cd build_cuda
  - rm -rf *
  - export PYTHONPATH=`pwd`/src
  - export PATH=/v/apps/cmake/3.7.1-centos7/bin:$PATH
  - export INTELDIR=/v/apps/intel/composer_xe_2017/compilers_and_libraries_2017.1.132/linux
  - export CUDA_HOME=/v/apps/cuda/cuda-7.5.18
  - export OPENMM_CUDA_COMPILER=${CUDA_HOME}/bin/nvcc
  - export PATH=${CUDA_HOME}/bin:$PATH
  - export LM_LICENSE_FILE=/v/apps/intel/licenses/2017_l_PK5BF7J3.lic
  - export LD_LIBRARY_PATH=${CUDA_HOME}/lib:${CUDA_HOME}/lib64::${LD_LIBRARY_PATH}
  - export INSTALLDIR=`pwd`/testinstall
  - export OPENMM_LIB_PATH=${INSTALLDIR}/lib
  - export OPENMM_PLUGIN_DIR=${OPENMM_LIB_PATH}/plugins
  - export LD_LIBRARY_PATH=${OPENMM_LIB_PATH}:$LD_LIBRARY_PATH
  - cp -R /u/andysim/bin/openmm_gitlab_mpid $INSTALLDIR
  - source ${INTELDIR}/bin/iccvars.sh intel64
  - which python
  - which nvcc
  - CXX=icpc CC=icc CXXFLAGS='-std=c++11' cmake -DPYTHON_EXECUTABLE=`which python` -DCMAKE_PREFIX_PATH=$INSTALLDIR -DOPENMM_DIR=$INSTALLDIR ..
  - make -j2
  - ctest -VV
  - cd ..
  - rm -rf build_cuda