Howdy Loris, Attached is what I came up with for Dakota. As you can tell, I struggled with LAPACK and BLAS as well but I managed to wrangle a build.
Not quite up to EB standards for EasyConfigs so I hadn't sent upstream yet. But maybe you can improve upon it. Jack Perdue Lead Systems Administrator High Performance Research Computing TAMU Division of Research j-per...@tamu.edu http://hprc.tamu.edu HPRC Helpdesk: h...@hprc.tamu.edu On 6/6/19 9:20 AM, Loris Bennett wrote:
Hi, I've written the following Easyconfig for Dakota: homepage = 'https://dakota.sandia.gov/' description = """"A Multilevel Parallel Object-Oriented Framework for Design Optimization, Parameter Estimation, Uncertainty Quantification, and Sensitivity Analysis.""" toolchain = {'name': 'foss', 'version': '2018b'} toolchainopts = {'usempi': True, 'openmp': True} source_urls = ['https://dakota.sandia.gov/sites/default/files/distributions/public/'] sources = ['%(namelower)s-%(version)s-release-public.src.tar.gz'] checksums = ['1691a5272a5d2f7ae817c27e66adf9d0'] builddependencies = [ ('CMake', '3.12.1'), ('pkg-config', '0.29.2'), ('Boost', '1.67.0'), ('GSL', '2.5'), ] dependencies = [ ('Python', '3.6.6'), ('Perl', '5.28.0'), ] separate_build_dir = True configopts = "-DMPI_ENABLE=ON -DOPENMP_ENABLE=ON" sanity_check_paths = { 'files': ['bin/dakota'], 'dirs': ['bin', 'share'], } modextrapaths = {'PYTHONPATH': 'share/%(namelower)s/Python'} moduleclass = 'math' But I am getting the error: CMake Error at CMakeLists.txt:298 (find_package): Could not find a package configuration file provided by "LAPACK" with any of the following names: LAPACKConfig.cmake lapack-config.cmake Add the installation prefix of "LAPACK" to CMAKE_PREFIX_PATH or set "LAPACK_DIR" to a directory containing one of the above files. If "LAPACK" provides a separate development package or SDK, be sure it has been installed. What am I doing wrong? Cheers, Loris
# Authors:: Jack Perdue <j-per...@tamu.edu> - TAMU HPRC - http://hprc.tamu.edu easyblock = 'CMakeMake' name = 'Dakota' version = '6.9' pysuffix = '-Python-%(pyver)s' versionsuffix = pysuffix homepage = 'https://dakota.sandia.gov/' description = """ Dakota software's advanced parametric analyses enable design exploration, model calibration, risk analysis, and quantification of margins and uncertainty with computational models. """ toolchain = {'name': 'foss', 'version': '2018b'} toolchainopts = {'openmp': True} # https://dakota.sandia.gov/sites/default/files/distributions/public/dakota-6.9-release-public.src.tar.gz source_urls = ['https://dakota.sandia.gov/sites/default/files/distributions/public/'] sources = ['%(namelower)s-%(version)s-release-public.src.tar.gz'] # checksums = ['07c20e14cd7674785a737fa801f486e8'] # from the web site checksums = ['989b689278964b96496e3058b8ef5c2724d74bcd232f898fe450c51eba7fe0c2'] builddependencies = [ ('CMake', '3.12.1'), ] dependencies = [ ('Boost', '1.68.0', pysuffix), ('GSL', '2.5'), ('HDF5', '1.10.2'), ('Perl', '5.28.0'), ('Python', '2.7.15'), # Trilinos(optional), # 3 hour build ('X11', '20180604'), ] separate_build_dir = True # haven't figured out how to best do OpenBLAS for LAPACK yet configopts = """\ -DBLAS_LIBRARY_NAMES=openblas\ -DBLAS_LIBS=$EBROOTBLAS/lib/\ -DDAKOTA_HAVE_MPI=TRUE\ -DLAPACK_DIR=$EBROOTOPENBLAS\ -DLAPACK_LIBS=$EBROOTOPENBLAS/lib\ -DUSE_MPI=TRUE\ """ prebuildopts = """ for x in `find . -name link.txt` ; do sed -e "s,-L$EBROOTOPENBLAS/lib,-L$EBROOTOPENBLAS/lib -lopenblas," -i.eb $x done sed -e 's/#include <cfloat>/#include <cmath>/' -i.eb\ ../%(namelower)s-%(version)s.0.src/packages/external/JEGA/Utilities/src/DiscreteDesignVariableNature.cpp """ parallel = 1 sanity_check_paths = { 'files': ['bin/dakota', 'include/DakotaLeastSq.hpp', 'lib/libdakota_src_fortran.so'], 'dirs': ['share/dakota/Bash'], } moduleclass = 'math'
