spack/var/spack/repos/builtin/packages/esmf/package.py
2024-10-11 03:43:51 +02:00

484 lines
20 KiB
Python

# Copyright 2013-2024 Lawrence Livermore National Security, LLC and other
# Spack Project Developers. See the top-level COPYRIGHT file for details.
#
# SPDX-License-Identifier: (Apache-2.0 OR MIT)
import os
import sys
from spack.build_environment import dso_suffix, stat_suffix
from spack.package import *
class Esmf(MakefilePackage, PythonExtension):
"""The Earth System Modeling Framework (ESMF) is high-performance, flexible
software infrastructure for building and coupling weather, climate, and
related Earth science applications. The ESMF defines an architecture for
composing complex, coupled modeling systems and includes data structures
and utilities for developing individual models.
The National Unified Operational Prediction Capability (NUOPC) Layer
defines a common model architecture to support interoperable ESMF components.
The NUOPC Layer is included with the ESMF package."""
homepage = "https://earthsystemmodeling.org/"
url = "https://github.com/esmf-org/esmf/archive/v8.4.1.tar.gz"
git = "https://github.com/esmf-org/esmf.git"
maintainers("climbfuji", "jedwards4b", "AlexanderRichert-NOAA", "theurich", "uturuncoglu")
# Develop is a special name for spack and is always considered the newest version
version("develop", branch="develop")
# generate chksum with 'spack checksum esmf@x.y.z'
version("8.7.0", sha256="d7ab266e2af8c8b230721d4df59e61aa03c612a95cc39c07a2d5695746f21f56")
version("8.6.1", sha256="dc270dcba1c0b317f5c9c6a32ab334cb79468dda283d1e395d98ed2a22866364")
version("8.6.0", sha256="ed057eaddb158a3cce2afc0712b49353b7038b45b29aee86180f381457c0ebe7")
version("8.5.0", sha256="acd0b2641587007cc3ca318427f47b9cae5bfd2da8d2a16ea778f637107c29c4")
version("8.4.2", sha256="969304efa518c7859567fa6e65efd960df2b4f6d72dbf2c3f29e39e4ab5ae594")
version("8.4.1", sha256="1b54cee91aacaa9df400bd284614cbb0257e175f6f3ec9977a2d991ed8aa1af6")
version(
"8.4.0",
sha256="28531810bf1ae78646cda6494a53d455d194400f19dccd13d6361871de42ed0f",
deprecated=True,
)
version("8.3.1", sha256="6c39261e55dcdf9781cdfa344417b9606f7f961889d5ec626150f992f04f146d")
version(
"8.3.0",
sha256="0ff43ede83d1ac6beabd3d5e2a646f7574174b28a48d1b9f2c318a054ba268fd",
deprecated=True,
)
version("8.3.0b09", commit="5b7e546c4ba350bff9c9ebd00e5fa1c6315d17da", deprecated=True)
version("8.2.0", sha256="27866c31fdb63c58e78211de970470ca02d274f5d4d6d97e94284d63b1c1d9e4")
version("8.1.1", sha256="629690c7a488e84ac7252470349458d7aaa98b54c260f8b3911a2e2f3e713dd0")
version(
"8.1.0",
sha256="226219ec61cace89f4678eece93188155d7cbb50a13ec4c9c93174ef3d58d7c0",
deprecated=True,
)
version("8.0.1", sha256="13ce2ca0ae622548c00f7bb18317fb100235ca8b7ddbfac7e201a339e8eb05a3")
version(
"8.0.0",
sha256="4b7904fdc935710071c4aafb9370834d40c2ee06365a8b5845317be8f71bf51f",
deprecated=True,
)
version(
"7.1.0r",
sha256="e08f21544083dcbe162b472852e321f8df14f4f711f35508403d32df438367a7",
deprecated=True,
)
depends_on("c", type="build") # generated
depends_on("cxx", type="build") # generated
depends_on("fortran", type="build") # generated
variant("mpi", default=True, description="Build with MPI support")
variant("external-lapack", default=False, description="Build with external LAPACK library")
variant("netcdf", default=True, description="Build with NetCDF support")
variant("pnetcdf", default=False, description="Build with pNetCDF support")
variant("xerces", default=False, description="Build with Xerces support")
variant(
"external-parallelio",
default=True,
description="Build with external parallelio library",
when="@8.3.1:",
)
variant("debug", default=False, description="Build with debugging symbols and options enabled")
variant("shared", default=True, description="Build shared library")
# 'esmf_os', 'esmf_comm', 'esmf_pio' variants allow override values for their corresponding
# build environment variables. Documentation, including valid values, can be found at
# https://earthsystemmodeling.org/docs/release/latest/ESMF_usrdoc/node10.html#SECTION000105000000000000000
variant("esmf_os", default="auto", description="Override for ESMF_OS variable")
variant("esmf_comm", default="auto", description="Override for ESMF_COMM variable")
variant("esmf_pio", default="auto", description="Override for ESMF_PIO variable")
# Set the 'snapshot' variant any time a beta snapshot is used in order to obtain
# correct module name behavior for MAPL.
variant(
"snapshot",
default="none",
description="Named variant for snapshots versions (e.g., 'b09')",
)
# The way python is handled here is only avialable >=8.4.0
# https://github.com/esmf-org/esmf/releases/tag/v8.4.0
variant("python", default=False, description="Build python bindings", when="@8.4.0:")
# Optional dependencies
depends_on("mpi", when="+mpi")
depends_on("lapack@3:", when="+external-lapack")
depends_on("netcdf-c@3.6:", when="+netcdf")
depends_on("netcdf-fortran@3.6:", when="+netcdf")
depends_on("parallel-netcdf@1.2.0:", when="+pnetcdf")
depends_on("xerces-c@3.1.0:", when="+xerces")
depends_on("parallelio@2.5.7: +mpi", when="@8.3+external-parallelio+mpi")
depends_on("parallelio@2.5.7: ~mpi", when="@8.3+external-parallelio~mpi")
depends_on("parallelio@2.5.9: +mpi", when="@8.4+external-parallelio+mpi")
depends_on("parallelio@2.5.9: ~mpi", when="@8.4+external-parallelio~mpi")
depends_on("parallelio@2.5.10: +mpi", when="@8.5:+external-parallelio+mpi")
depends_on("parallelio@2.5.10: ~mpi", when="@8.5:+external-parallelio~mpi")
depends_on("cmake@3.5.2:", type="build", when="~external-parallelio")
# python library
with when("+python"):
extends("python")
depends_on("py-pip")
depends_on("py-setuptools", type="build")
depends_on("py-wheel", type="build")
depends_on("py-mpi4py", when="+mpi")
depends_on("py-numpy")
# In esmf@8.4.0, esmx was introduced which depends on py-pyyaml
with when("@8.4.0:"):
depends_on("python", type="run")
depends_on("py-pyyaml", type="run")
# Testing dependencies
depends_on("perl", type="test")
conflicts("%aocc", when="@:8.3")
# Make esmf build with newer intel versions
patch("intel.patch", when="@:7.0 %intel@17:")
# Make esmf build with newer gcc versions
# https://sourceforge.net/p/esmf/esmf/ci/3706bf758012daebadef83d6575c477aeff9c89b/
patch("gcc.patch", when="@:7.0 %gcc@6:")
# Fix undefined reference errors with mvapich2
# https://sourceforge.net/p/esmf/esmf/ci/34de0ccf556ba75d35c9687dae5d9f666a1b2a18/
patch("mvapich2.patch", when="@:7.0")
# explicit type cast of variables from long to int
patch("longtoint.patch", when="@:8.3.2 %cce@14:")
patch("longtoint.patch", when="@:8.3.2 %oneapi@2022:")
# Allow different directories for creation and
# installation of dynamic libraries on OSX:
patch("darwin_dylib_install_name.patch", when="platform=darwin @:7.0")
# Missing include file for newer gcc compilers
# https://trac.macports.org/ticket/57493
patch("cstddef.patch", when="@7.1.0r %gcc@8:")
# Skip info print of ESMF_CPP due to permission denied errors
# https://github.com/spack/spack/issues/35957
patch("esmf_cpp_info.patch")
@when("+python")
def patch(self):
# The pyproject.toml file uses a dynamically generated version from git
# However, this results in a version of 0.0.0 and a mismatch with the loaded version
# so this hardcodes it to match the library's version
filter_file(
"""dynamic = \\[\\s+"version"\\s+\\]""",
f"""version = "{self.version}" """,
os.path.join("src/addon/esmpy/pyproject.toml"),
)
def setup_run_environment(self, env):
env.set("ESMFMKFILE", os.path.join(self.prefix.lib, "esmf.mk"))
class PythonPipBuilder(spack.build_systems.python.PythonPipBuilder):
@property
def build_directory(self):
return os.path.join(self.stage.source_path, "src/addon/esmpy")
class MakefileBuilder(spack.build_systems.makefile.MakefileBuilder):
# This is strictly required on Cray systems that use
# the Cray compiler wrappers, where we need to swap
# out the spack compiler wrappers in esmf.mk with the
# Cray wrappers. It doesn't hurt/have any effect on
# other systems where the logic in setup_build_environment
# below sets the compilers to the MPI wrappers.
filter_compiler_wrappers("esmf.mk", relative_root="lib")
# Make script from mvapich2.patch executable
@when("@:7.0")
@run_before("build")
def chmod_scripts(self):
chmod = which("chmod")
chmod("+x", "scripts/libs.mvapich2f90")
def url_for_version(self, version):
if version < Version("8.0.0"):
# Older ESMF releases had a custom tag format ESMF_x_y_z
return "https://github.com/esmf-org/esmf/archive/ESMF_{0}.tar.gz".format(
version.underscored
)
else:
# Starting with ESMF 8.0.0 releases are in the form vx.y.z
return "https://github.com/esmf-org/esmf/archive/refs/tags/v{0}.tar.gz".format(
version.dotted
)
def setup_build_environment(self, env):
spec = self.spec
# Installation instructions can be found at:
# http://www.earthsystemmodeling.org/esmf_releases/last_built/ESMF_usrdoc/node9.html
# Unset any environment variables that may influence the installation.
for var in os.environ:
if var.startswith("ESMF_"):
env.unset(var)
######################################
# Build and Installation Directories #
######################################
# The environment variable ESMF_DIR must be set to the full pathname
# of the top level ESMF directory before building the framework.
env.set("ESMF_DIR", self.stage.source_path)
# This variable specifies the prefix of the installation path used
# with the install target.
env.set("ESMF_INSTALL_PREFIX", prefix)
# Installation subdirectories default to:
# bin/binO/Linux.gfortran.64.default.default
env.set("ESMF_INSTALL_BINDIR", "bin")
env.set("ESMF_INSTALL_LIBDIR", "lib")
env.set("ESMF_INSTALL_MODDIR", "include")
# Allow compiler flags to carry through from compiler spec
env.set("ESMF_CXXCOMPILEOPTS", " ".join(spec.compiler_flags["cxxflags"]))
env.set("ESMF_F90COMPILEOPTS", " ".join(spec.compiler_flags["fflags"]))
# ESMF will simply not build with Intel using backing GCC 8, in that
# case you need to point to something older, below is commented but is
# an example
# env.set("ESMF_CXXCOMPILEOPTS", "-O2 -std=c++11 -gcc-name=/usr/bin/gcc")
# env.set("ESMF_F90COMPILEOPTS", "-O2 -gcc-name=/usr/bin/gcc")
############
# Compiler #
############
# ESMF_COMPILER must be set to select which Fortran and
# C++ compilers are being used to build the ESMF library.
if self.pkg.compiler.name == "gcc":
env.set("ESMF_COMPILER", "gfortran")
with self.pkg.compiler.compiler_environment():
gfortran_major_version = int(
spack.compiler.get_compiler_version_output(
self.pkg.compiler.fc, "-dumpversion"
).split(".")[0]
)
elif self.pkg.compiler.name == "intel" or self.pkg.compiler.name == "oneapi":
env.set("ESMF_COMPILER", "intel")
elif self.pkg.compiler.name in ["clang", "apple-clang"]:
env.set("ESMF_COMPILER", "gfortranclang")
with self.pkg.compiler.compiler_environment():
gfortran_major_version = int(
spack.compiler.get_compiler_version_output(
self.pkg.compiler.fc, "-dumpversion"
).split(".")[0]
)
elif self.pkg.compiler.name == "nag":
env.set("ESMF_COMPILER", "nag")
elif self.pkg.compiler.name == "pgi":
env.set("ESMF_COMPILER", "pgi")
elif self.pkg.compiler.name == "nvhpc":
env.set("ESMF_COMPILER", "nvhpc")
elif self.pkg.compiler.name == "cce":
env.set("ESMF_COMPILER", "cce")
elif self.pkg.compiler.name == "aocc":
env.set("ESMF_COMPILER", "aocc")
else:
msg = "The compiler you are building with, "
msg += '"{0}", is not supported by ESMF.'
raise InstallError(msg.format(self.pkg.compiler.name))
if spec.satisfies("+mpi"):
env.set("ESMF_CXX", spec["mpi"].mpicxx)
env.set("ESMF_C", spec["mpi"].mpicc)
env.set("ESMF_F90", spec["mpi"].mpifc)
else:
env.set("ESMF_CXX", spack_cxx)
env.set("ESMF_C", spack_cc)
env.set("ESMF_F90", spack_fc)
# This environment variable controls the build option.
if spec.satisfies("+debug"):
# Build a debuggable version of the library.
env.set("ESMF_BOPT", "g")
else:
# Build an optimized version of the library.
env.set("ESMF_BOPT", "O")
if (
self.pkg.compiler.name in ["gcc", "clang", "apple-clang"]
and gfortran_major_version >= 10
and (self.spec.satisfies("@:8.2.99") or self.spec.satisfies("@8.3.0b09"))
):
env.set("ESMF_F90COMPILEOPTS", "-fallow-argument-mismatch")
#######
# OS #
#######
# ESMF_OS must be set for Cray systems
# But spack no longer gives arch == cray
if self.pkg.compiler.name == "cce" or "^cray-mpich" in self.spec:
env.set("ESMF_OS", "Unicos")
# Allow override of ESMF_OS:
os_variant = spec.variants["esmf_os"].value
if os_variant != "auto":
env.set("ESMF_OS", os_variant)
#######
# MPI #
#######
# ESMF_COMM must be set to indicate which MPI implementation
# is used to build the ESMF library.
if spec.satisfies("+mpi"):
if self.spec.satisfies("^[virtuals=mpi] cray-mpich"):
env.set("ESMF_COMM", "mpi")
# https://github.com/jcsda/spack-stack/issues/517
if self.spec.satisfies("@:8.4.1"):
env.set("ESMF_CXXLINKLIBS", "-lmpifort -lmpi")
elif spec.satisfies("^[virtuals=mpi] mvapich2"):
env.set("ESMF_COMM", "mvapich2")
elif spec.satisfies("^[virtuals=mpi] mpich"):
if self.spec.satisfies("@:8.2.99"):
env.set("ESMF_COMM", "mpich3")
else:
env.set("ESMF_COMM", "mpich")
elif spec.satisfies("^[virtuals=mpi] openmpi") or spec.satisfies(
"^[virtuals=mpi] hpcx-mpi"
):
env.set("ESMF_COMM", "openmpi")
elif (
spec.satisfies("^[virtuals=mpi] intel-parallel-studio+mpi")
or spec.satisfies("^[virtuals=mpi] intel-mpi")
or spec.satisfies("^[virtuals=mpi] intel-oneapi-mpi")
):
env.set("ESMF_COMM", "intelmpi")
elif spec.satisfies("^[virtuals=mpi] mpt"):
# MPT is the HPE (SGI) variant of mpich
env.set("ESMF_COMM", "mpt")
else:
# Force use of the single-processor MPI-bypass library.
env.set("ESMF_COMM", "mpiuni")
# Allow override of ESMF_COMM:
comm_variant = spec.variants["esmf_comm"].value
if comm_variant != "auto":
env.set("ESMF_COMM", comm_variant)
##########
# LAPACK #
##########
if spec.satisfies("+external-lapack"):
# A system-dependent external LAPACK/BLAS installation is used
# to satisfy the external dependencies of the LAPACK-dependent
# ESMF code.
env.set("ESMF_LAPACK", "system")
# Specifies the path where the LAPACK library is located.
env.set("ESMF_LAPACK_LIBPATH", spec["lapack"].prefix.lib)
# Specifies the linker directive needed to link the LAPACK library
# to the application.
env.set("ESMF_LAPACK_LIBS", spec["lapack"].libs.link_flags) # noqa
else:
env.set("ESMF_LAPACK", "internal")
##########
# NetCDF #
##########
if spec.satisfies("+netcdf"):
# ESMF provides the ability to read Grid and Mesh data in
# NetCDF format.
env.set("ESMF_NETCDF", "nc-config")
env.set("ESMF_NFCONFIG", "nf-config")
netcdfc = spec["netcdf-c"]
if netcdfc.satisfies("~shared"):
nc_config = which(os.path.join(netcdfc.prefix.bin, "nc-config"))
nc_flags = nc_config("--static", "--libs", output=str).strip()
env.set("ESMF_NETCDF_LIBS", nc_flags)
###################
# Parallel-NetCDF #
###################
if spec.satisfies("+pnetcdf"):
# ESMF provides the ability to write Mesh weights
# using Parallel-NetCDF.
# When defined, enables the use of Parallel-NetCDF.
# ESMF_PNETCDF_LIBS will be set to "-lpnetcdf".
env.set("ESMF_PNETCDF", "pnetcdf-config")
##############
# ParallelIO #
##############
if spec.satisfies("+external-parallelio"):
env.set("ESMF_PIO", "external")
env.set("ESMF_PIO_LIBPATH", spec["parallelio"].prefix.lib)
env.set("ESMF_PIO_INCLUDE", spec["parallelio"].prefix.include)
# Allow override of ESMF_PIO:
pio_variant = spec.variants["esmf_pio"].value
if pio_variant != "auto":
env.set("ESMF_PIO", pio_variant)
##########
# XERCES #
##########
if spec.satisfies("+xerces"):
# ESMF provides the ability to read Attribute data in
# XML file format via the XERCES C++ library.
# ESMF_XERCES_LIBS will be set to "-lxerces-c".
env.set("ESMF_XERCES", "standard")
# FIXME: determine if the following are needed
# ESMF_XERCES_INCLUDE
# ESMF_XERCES_LIBPATH
#########################
# General build options #
#########################
# Static-only option:
if spec.satisfies("~shared"):
env.set("ESMF_SHARED_LIB_BUILD", "OFF")
# https://github.com/JCSDA/spack-stack/issues/956
if spec.satisfies("+shared"):
if sys.platform == "darwin":
env.set("ESMF_TRACE_LIB_BUILD", "OFF")
@run_after("install")
def post_install(self):
install_tree("cmake", self.prefix.cmake)
# Several applications using ESMF are affected by CMake
# capitalization issue. The following fix allows all apps
# to use as-is. Note that since the macOS file system is
# case-insensitive, this step is not allowed on macOS.
if sys.platform != "darwin":
for prefix in [dso_suffix, stat_suffix]:
library_path = os.path.join(self.prefix.lib, "libesmf.%s" % prefix)
if os.path.exists(library_path):
os.symlink(library_path, os.path.join(self.prefix.lib, "libESMF.%s" % prefix))
def check(self):
make("check", parallel=False)
def setup_dependent_build_environment(self, env, dependent_spec):
env.set("ESMFMKFILE", os.path.join(self.prefix.lib, "esmf.mk"))
def install(self, pkg, spec, prefix):
make("install")
if spec.satisfies("+python"):
# build the python library
python_builder = PythonPipBuilder(pkg)
python_builder.install(pkg, spec, prefix)