CMake updates

.gitmodules

@@ -1,6 +1,6 @@
 [submodule "utils/spiner"]
 	path = utils/spiner
-	url = https://github.com/lanl/spiner.git
+  url = https://github.com/lanl/spiner.git
 [submodule "utils/variant"]
 	path = utils/variant
 	url = https://github.com/mpark/variant.git
@@ -10,3 +10,6 @@
 [submodule "utils/kokkos"]
 	path = utils/kokkos
 	url = https://github.com/kokkos/kokkos.git
+[submodule "utils/ports-of-call"]
+	path = utils/ports-of-call
+	url = https://github.com/lanl/ports-of-call.git

CMakeLists.txt

@@ -1,62 +1,63 @@
-# © 2021. Triad National Security, LLC. All rights reserved.  This
-# program was produced under U.S. Government contract
-# 89233218CNA000001 for Los Alamos National Laboratory (LANL), which
-# is operated by Triad National Security, LLC for the U.S.  Department
-# of Energy/National Nuclear Security Administration. All rights in
-# the program are reserved by Triad National Security, LLC, and the
-# U.S. Department of Energy/National Nuclear Security
-# Administration. The Government is granted for itself and others
-# acting on its behalf a nonexclusive, paid-up, irrevocable worldwide
-# license in this material to reproduce, prepare derivative works,
-# distribute copies to the public, perform publicly and display
-# publicly, and to permit others to do so.
-
-cmake_minimum_required(VERSION 3.14)
-
-project("singularity-opac"
-      VERSION 0.0.1
-      DESCRIPTION
-        ""
-      HOMEPAGE_URL "https://github.com/lanl/singularity-opac/"
-)
+# © 2021. Triad National Security, LLC. All rights reserved.  This program was
+# produced under U.S. Government contract 89233218CNA000001 for Los Alamos
+# National Laboratory (LANL), which is operated by Triad National Security, LLC
+# for the U.S.  Department of Energy/National Nuclear Security Administration.
+# All rights in the program are reserved by Triad National Security, LLC, and
+# the U.S. Department of Energy/National Nuclear Security Administration. The
+# Government is granted for itself and others acting on its behalf a
+# nonexclusive, paid-up, irrevocable worldwide license in this material to
+# reproduce, prepare derivative works, distribute copies to the public, perform
+# publicly and display publicly, and to permit others to do so.
+
+cmake_minimum_required(VERSION 3.19)
+
+project(
+  "singularity-opac"
+  VERSION 0.0.1
+  DESCRIPTION ""
+  HOMEPAGE_URL "https://github.com/lanl/singularity-opac/")
 
 # Don't allow in-source builds
 file(TO_CMAKE_PATH "${PROJECT_BINARY_DIR}/CMakeLists.txt" LOC_PATH)
 if(EXISTS "${LOC_PATH}")
-  message(FATAL_ERROR
-    "You cannot build in a source directory (or any directory with a CMakeLists.txt file). "
-    "Please make a build subdirectory. Feel free to remove CMakeCache.txt and CMakeFiles.")
+  message(
+    FATAL_ERROR
+      "You cannot build in a source directory (or any directory with a CMakeLists.txt file). "
+      "Please make a build subdirectory. Feel free to remove CMakeCache.txt and CMakeFiles."
+  )
 endif()
 
 # If the user doesn't specify a build type, prefer RelWithDebInfo
 set(default_build_type "RelWithDebInfo")
 if(NOT CMAKE_BUILD_TYPE AND NOT CMAKE_CONFIGURATION_TYPES)
-  message(STATUS "Setting build type to '${default_build_type}' as none was specified.")
-  set(CMAKE_BUILD_TYPE "${default_build_type}" CACHE
-    STRING "Choose the type of build." FORCE)
+  message(
+    STATUS
+      "Setting build type to '${default_build_type}' as none was specified.")
+  set(CMAKE_BUILD_TYPE
+      "${default_build_type}"
+      CACHE STRING "Choose the type of build." FORCE)
   # Set the possible values of build type for cmake-gui
-  set_property(CACHE CMAKE_BUILD_TYPE PROPERTY STRINGS
-    "Debug" "Release" "MinSizeRel" "RelWithDebInfo")
+  set_property(CACHE CMAKE_BUILD_TYPE PROPERTY STRINGS "Debug" "Release"
+                                               "MinSizeRel" "RelWithDebInfo")
 endif()
 
 list(APPEND CMAKE_MODULE_PATH ${CMAKE_CURRENT_LIST_DIR}/cmake)
 
-# simplier interface, but note it may make things more convoluted
-# as the project grows in size. For now, this is fine, but may
-# want to split flags if more source is added.
-add_library(${PROJECT_NAME} INTERFACE IMPORTED GLOBAL)
+# simplier interface, but note it may make things more convoluted as the project
+# grows in size. For now, this is fine, but may want to split flags if more
+# source is added.
+add_library(singularity-opac INTERFACE IMPORTED GLOBAL)
 # so we can use with add_subdirectory
-add_library(${PROJECT_NAME}::${PROJECT_NAME} ALIAS ${PROJECT_NAME})
+add_library(singularity-opac::singularity-opac ALIAS singularity-opac)
 
-add_library (singularity-opac::flags INTERFACE IMPORTED GLOBAL)
-target_include_directories(singularity-opac::flags
-                           INTERFACE
-                           $<BUILD_INTERFACE:${PROJECT_SOURCE_DIR}>)
+target_include_directories(
+  singularity-opac INTERFACE $<BUILD_INTERFACE:${PROJECT_SOURCE_DIR}>
+                             $<INSTALL_INTERFACE:install/)
 
-include (SetupDeps)
-include (SetupOptions)
-include (SetupCompilers)
-include (SetupFlags)
+include(SetupDeps)
+include(SetupOptions)
+include(SetupCompilers)
+include(SetupFlags)
 
 include(GNUInstallDirs)
 include(CTest)
@@ -67,49 +68,22 @@ if(CMAKE_PROJECT_NAME STREQUAL PROJECT_NAME)
   set(IS_TOPLEVEL_PROJECT TRUE)
 endif()
 
-
 set(CMAKE_EXPORT_COMPILE_COMMANDS On)
 
-# Patches variant to be compatible with cuda
-# Assumes "patch" is present on system
+# Patches variant to be compatible with cuda Assumes "patch" is present on
+# system
 message(STATUS "Patching mpark::variant to support GPUs")
-execute_process(COMMAND patch -N -s -V never
-                ${CMAKE_CURRENT_SOURCE_DIR}/utils/variant/include/mpark/variant.hpp
-                ${CMAKE_CURRENT_SOURCE_DIR}/utils/cuda_compatibility.patch)
-
-# xl fix
-target_compile_options(singularity-opac::flags INTERFACE
-                       $<$<COMPILE_LANG_AND_ID:CXX,XL>:-std=c++1y;-qxflag=disable__cplusplusOverride>)
-target_link_options(singularity-opac::flags INTERFACE
-                    $<$<COMPILE_LANG_AND_ID:CXX,XL>:-std=c++1y;-qxflag=disable__cplusplusOverride>)
-
-if(CMAKE_BUILD_TYPE STREQUAL "Release")
-  target_compile_options(singularity-opac::flags INTERFACE
-                         -use_fast_math)
-elseif(CMAKE_BUILD_TYPE STREQUAL "Debug" AND SINGULARITY_BETTER_DEBUG_FLAGS)
-  target_compile_options(
-    singularity-opac::flags
-    INTERFACE
-    "$<$<COMPILE_LANGUAGE:CXX>:-G;-lineinfo;>"
-    )
-endif()
+execute_process(
+  COMMAND
+    patch -N -s -V never
+    ${CMAKE_CURRENT_SOURCE_DIR}/utils/variant/include/mpark/variant.hpp
+    ${CMAKE_CURRENT_SOURCE_DIR}/utils/cuda_compatibility.patch)
 
 # Invoke CMake scripts for setup
 if(SINGULARITY_INSTALL_LIBRARY)
-  include (SetupInstall)
+  include(SetupInstall)
 endif()
 
 if(SINGULARITY_BUILD_TESTS)
   add_subdirectory(test)
 endif()
-
-set(CPACK_RESOURCE_FILE_LICENSE "${PROJECT_SOURCE_DIR}/LICENSE")
-
-include(CPack)
-
-include(FeatureSummary)
-feature_summary(WHAT ALL
-                INCLUDE_QUIET_PACKAGES
-                DESCRIPTION "Enabled Features:"
-                VAR enabledFeaturesText)
-message(STATUS "${enabledFeaturesText}")

cmake/SetupDeps.cmake

@@ -1,76 +1,77 @@
 include(FeatureSummary)
-#=======================================
-# Setup CUDAToolkit
-# - provideds CUDA::toolkit
-#=======================================
-if (NOT TARGET CUDA::toolkit)
+# =======================================
+# Setup CUDAToolkit - provideds CUDA::toolkit
+# =======================================
+if(NOT TARGET CUDA::toolkit)
   find_package(CUDAToolkit QUIET)
 else()
   message(status "CUDA::toolkit provided by parent package")
 endif()
 
-#=======================================
-# Setup ports of call
-# - provides PortsofCall::PortsofCall
-#=======================================
-find_package(PortsofCall REQUIRED)
-target_link_libraries(singularity-opac::flags INTERFACE PortsofCall::PortsofCall)
+# =======================================
+# Setup ports of call - provides PortsofCall::PortsofCall
+# =======================================
+find_package(ports-of-call QUIET)
+if(NOT ports-of-call_FOUND)
+  add_subdirectory(utils/ports-of-call)
+endif()
+target_link_libraries(singularity-opac INTERFACE ports-of-call::ports-of-call)
 
-#=======================================
-# Setup Kokkos
-# - provides Kokkos::kokkos
-#=======================================
-if (NOT TARGET Kokkos::kokkos)
+# =======================================
+# Setup Kokkos - provides Kokkos::kokkos
+# =======================================
+if(NOT TARGET Kokkos::kokkos)
   find_package(Kokkos QUIET)
 else()
   message(status "Kokkos::kokkos provided by parent package")
 endif()
+target_link_libraries(singularity-opac INTERFACE Kokkos::kokkos)
 
-#=======================================
-# Find HDF5
-# - [email protected]+ provides HDF5::HDF5, but
-#   prior versions do not
-#=======================================
-# Can't play the target games above unless using
-# cmake 3.20+, so leave this one for now.
-find_package(HDF5 COMPONENTS C HL QUIET)
+# =======================================
+# Find HDF5 - [email protected]+ provides HDF5::HDF5, but prior versions do not
+# =======================================
+# Can't play the target games above unless using cmake 3.20+, so leave this one
+# for now.
+find_package(
+  HDF5
+  COMPONENTS C HL
+  QUIET)
 
-# findpackage doesnt export an interface for HDF5,
-# so create one
-if (HDF5_FOUND)
-    target_compile_definitions(singularity-opac::flags INTERFACE SPINER_USE_HDF)
-    add_library(${PROJECT_NAME}::hdf5 INTERFACE IMPORTED)
-    set_target_properties(${PROJECT_NAME}::hdf5
-    PROPERTIES
-        INTERFACE_LINK_LIBRARIES "${HDF5_LIBRARIES};${HDF5_HL_LIBRARIES}"
-        INTERFACE_COMPILE_DEFINITIONS "SINGULARITY_USE_HDF5;SPINER_USE_HDF"
-        INTERFACE_INCLUDE_DIRECTORIES "${HDF5_INCLUDE_DIRS}"
-    )
+# findpackage doesnt export an interface for HDF5, so create one
+if(HDF5_FOUND)
+  target_compile_definitions(singularity-opac INTERFACE SPINER_USE_HDF)
+  set_target_properties(
+    singularity-opac
+    PROPERTIES INTERFACE_LINK_LIBRARIES "${HDF5_LIBRARIES};${HDF5_HL_LIBRARIES}"
+               INTERFACE_COMPILE_DEFINITIONS
+               "SINGULARITY_USE_HDF5;SPINER_USE_HDF"
+               INTERFACE_INCLUDE_DIRECTORIES "${HDF5_INCLUDE_DIRS}")
 
-    # if HDF5 is parallel, also get MPI libraries
-    if (HDF5_IS_PARALLEL)
-      message(status "Parallel HDF5 found. Looking for MPI")
-      # Provides MPI::MPI_CXX
-      if (NOT TARGET MPI::MPI_CXX)
-	find_package(MPI COMPONENTS)# CXX REQUIRED)
-	if (NOT MPI_FOUND)
-	  message(FATAL_ERROR
-	    "HDF5 parallel found, but could not find MPI! "
-	    "Try specifying a path to an MPI directory or MPI compiler "
-	    " via -DMPI_HOME=/path or -DMPI_CXX_COMPILER=/path, "
-	    "or set CMAKE_PREFIX_PATH to your preferred HDF5 directory "
-	    "via -DCMAKE_PREFIX_PATH=/path.")
-	endif()
-      else()
-	message("MPI::MPI_CXX provided by parent package")
+  # if HDF5 is parallel, also get MPI libraries
+  if(HDF5_IS_PARALLEL)
+    message(status "Parallel HDF5 found. Looking for MPI")
+    # Provides MPI::MPI_CXX
+    if(NOT TARGET MPI::MPI_CXX)
+      find_package(MPI COMPONENTS) # CXX REQUIRED)
+      if(NOT MPI_FOUND)
+        message(
+          FATAL_ERROR
+            "HDF5 parallel found, but could not find MPI! "
+            "Try specifying a path to an MPI directory or MPI compiler "
+            " via -DMPI_HOME=/path or -DMPI_CXX_COMPILER=/path, "
+            "or set CMAKE_PREFIX_PATH to your preferred HDF5 directory "
+            "via -DCMAKE_PREFIX_PATH=/path.")
       endif()
+    else()
+      message("MPI::MPI_CXX provided by parent package")
     endif()
+    target_link_libraries(singularity-opac INTERFACE MPI::MPI_CXX)
+  endif()
 endif()
 
-#=======================================
-# Setup Catch2
-# - provides Catch2::Catch2
-#=======================================
-if (NOT TARGET Catch2::Catch2)
+# =======================================
+# Setup Catch2 - provides Catch2::Catch2
+# =======================================
+if(NOT TARGET Catch2::Catch2)
   find_package(Catch2 QUIET)
 endif()