lammps/.gitlab-ci.yml
fce633aa5f4dmaster

.gitlab-ci.yml
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			image: ubuntu:latest

			test:

			before_script:

			# Install Linux Packages:
			- apt-get update
			- hostname
			- export HOME=/builds/exaalt/
			- env
			- apt-get --yes --force-yes install gfortran libblas-dev liblapack-dev
			- apt-get --yes --force-yes install cmake python gcc cmake-data g++ git wget
			- apt-get --yes --force-yes install pkg-config python-numpy python3-numpy libopenmpi-dev

			# Build LATTE:
			- cd /builds/exaalt/
			- git clone https://github.com/lanl/LATTE.git
			- cd LATTE
			- cp ./makefiles/makefile.CHOICES.gfort.lapack.lmp makefile.CHOICES
			- make

			# Build LAMMPS:
			- cd /builds/exaalt/lammps/lib/latte/
			- cp Makefile.lammps.gfortran Makefile.lammps
			- cd /builds/exaalt/lammps/src/
			- make yes-latte
			- make yes-molecule
			- make serial

			script:

			# Test LAMMPS-LATTE Example:
			- cd /builds/exaalt/lammps/examples/latte/
			- ../../src/lmp_serial -in in.latte.water