diff --git a/packages/h5hut/package.py b/packages/h5hut/package.py index 956f547..f8253a7 100644 --- a/packages/h5hut/package.py +++ b/packages/h5hut/package.py @@ -5,9 +5,70 @@ from spack.package import * -from spack.pkg.builtin.h5hut import H5hut as SpackH5hut -class H5hut(SpackH5hut): +class H5hut(AutotoolsPackage): + """H5hut (HDF5 Utility Toolkit). + High-Performance I/O Library for Particle-based Simulations.""" + + homepage = "https://amas.psi.ch/H5hut/" + url = "https://amas.web.psi.ch/Downloads/H5hut/H5hut-2.0.0rc3.tar.gz" + git = "https://gitlab.psi.ch/H5hut/src.git" version("2.0.0rc6", sha256="980a5c634877265bd3a862fbd439d973d44be9c1d2f840c3635e8c6375d62d7e") + version("2.0.0rc3", sha256="1ca9a9478a99e1811ecbca3c02cc49258050d339ffb1a170006eab4ab2a01790") + + version("master", branch="master") + + variant("fortran", default=True, description="Enable Fortran support") + variant("mpi", default=True, description="Enable MPI support") + + depends_on("autoconf", type="build", when="build_system=autotools") + depends_on("automake", type="build", when="build_system=autotools") + depends_on("libtool", type="build", when="build_system=autotools") + + depends_on("mpi", when="+mpi") + # h5hut +mpi uses the obsolete function H5Pset_fapl_mpiposix: + depends_on("hdf5@1.8:+mpi", when="+mpi") + depends_on("hdf5@1.8:", when="~mpi") + + # If built in parallel, the following error message occurs: + # install: .libs/libH5hut.a: No such file or directory + parallel = False + + @run_before("configure") + def validate(self): + """Checks if Fortran compiler is available.""" + + if "+fortran" in self.spec and not self.compiler.fc: + raise RuntimeError("Cannot build Fortran variant without a Fortran compiler.") + + def flag_handler(self, name, flags): + build_system_flags = [] + if name == "cflags" and self.spec.version < Version("2.0.0rc7"): + build_system_flags = ["-DH5_USE_110_API"] + return flags, None, build_system_flags + + def autoreconf(self, spec, prefix): + which("bash")("autogen.sh") + + def configure_args(self): + spec = self.spec + config_args = ["--enable-shared"] + + if "+fortran" in spec: + config_args.append("--enable-fortran") + + if "+mpi" in spec: + config_args.extend( + [ + "--enable-parallel", + "CC={0}".format(spec["mpi"].mpicc), + "CXX={0}".format(spec["mpi"].mpicxx), + ] + ) + + if "+fortran" in spec: + config_args.append("FC={0}".format(spec["mpi"].mpifc)) + + return config_args diff --git a/packages/opal-x/package.py b/packages/opal-x/package.py index 5615dcc..53688c6 100644 --- a/packages/opal-x/package.py +++ b/packages/opal-x/package.py @@ -54,9 +54,10 @@ class OpalX(CMakePackage, CudaPackage): depends_on("blas") depends_on("boost@1.82.0+mpi+chrono+filesystem+iostreams+regex+serialization+system+timer+python+shared") depends_on("cmake@3.25.2:", type="build") - depends_on("fftw@3.3.10") + depends_on("fftw@3.3.10 +mpi") depends_on("gsl@2.7+shared") depends_on("gnutls@3.5.19:") + depends_on("cuda@12.4.0:") depends_on("h5hut+mpi", when="+mpi") @@ -89,7 +90,7 @@ class OpalX(CMakePackage, CudaPackage): ] if '+cuda' in self.spec: - args.append("-DIPPL_PLATFORMS=cuda") + args.append("-DIPPL_PLATFORMS=CUDA") else: args.append("-DIPPL_PLATFORMS=openmp")