Merge pull request #3316 from aherrmann/pr_mpi

MPI support for HDF5 and SGE support for OpenMPI

pkgs/development/python-modules/h5py/default.nix

@@ -0,0 +1,43 @@
+{ stdenv, fetchurl, python, buildPythonPackage
+, numpy, hdf5, cython
+, mpiSupport ? false, mpi4py ? null, mpi ? null }:
+
+assert mpiSupport == hdf5.mpiSupport;
+assert mpiSupport -> mpi != null
+  && mpi4py != null
+  && mpi == mpi4py.mpi
+  && mpi == hdf5.mpi
+  ;
+
+with stdenv.lib;
+
+buildPythonPackage rec {
+  name = "h5py-2.3.1";
+
+  src = fetchurl {
+    url = "https://pypi.python.org/packages/source/h/h5py/${name}.tar.gz";
+    md5 = "8f32f96d653e904d20f9f910c6d9dd91";
+  };
+
+  setupPyBuildFlags = [ "--hdf5=${hdf5}" ]
+    ++ optional mpiSupport "--mpi"
+    ;
+  setupPyInstallFlags = setupPyBuildFlags;
+
+  preBuild = if mpiSupport then "export CC=${mpi}/bin/mpicc" else "";
+
+  buildInputs = [ hdf5 cython ]
+    ++ optional mpiSupport mpi
+    ;
+  propagatedBuildInputs = [ numpy ]
+    ++ optional mpiSupport mpi4py
+    ;
+
+  meta = {
+    description = "
+      The h5py package is a Pythonic interface to the HDF5 binary data format.
+    ";
+    homepage = "http://www.h5py.org/";
+    license = stdenv.lib.licenses.bsd2;
+  };
+}

pkgs/development/python-modules/mpi4py/default.nix

@@ -0,0 +1,45 @@
+{ stdenv, fetchurl, python, buildPythonPackage, mpi, openssh }:
+
+buildPythonPackage rec {
+  name = "mpi4py-1.3.1";
+
+  src = fetchurl {
+    url = "https://bitbucket.org/mpi4py/mpi4py/downloads/${name}.tar.gz";
+    sha256 = "e7bd2044aaac5a6ea87a87b2ecc73b310bb6efe5026031e33067ea3c2efc3507";
+  };
+
+  passthru = {
+    inherit mpi;
+  };
+
+  configurePhase = "";
+
+  installPhase = ''
+    mkdir -p "$out/lib/${python.libPrefix}/site-packages"
+    export PYTHONPATH="$out/lib/${python.libPrefix}/site-packages:$PYTHONPATH"
+
+    ${python}/bin/${python.executable} setup.py install \
+      --install-lib=$out/lib/${python.libPrefix}/site-packages \
+      --prefix="$out"
+
+    # --install-lib:
+    # sometimes packages specify where files should be installed outside the usual
+    # python lib prefix, we override that back so all infrastructure (setup hooks)
+    # work as expected
+  '';
+
+  setupPyBuildFlags = ["--mpicc=${mpi}/bin/mpicc"];
+
+  buildInputs = [ mpi ];
+  # Requires openssh for tests. Tests of dependent packages will also fail,
+  # if openssh is not present. E.g. h5py with mpi support.
+  propagatedBuildInputs = [ openssh ];
+
+  meta = {
+    description = "
+      Provides Python bindings for the Message Passing Interface standard.
+    ";
+    homepage = "http://code.google.com/p/mpi4py/";
+    license = stdenv.lib.licenses.bsd3;
+  };
+}