Implement PME solve in SYCL

[alexxy/gromacs.git] / src / gromacs / ewald / CMakeLists.txt

diff --git a/src/gromacs/ewald/CMakeLists.txt b/src/gromacs/ewald/CMakeLists.txt
index ba9faa378e93ad6155e43b81cd1681610c33c8c6..fd24566ee0c883f576b1f9ed6ab3e7efb32e2238 100644 (file)
--- a/src/gromacs/ewald/CMakeLists.txt
+++ b/src/gromacs/ewald/CMakeLists.txt
@@ -2,7 +2,7 @@
 # This file is part of the GROMACS molecular simulation package.
 #
 # Copyright (c) 2014,2015,2016,2017,2018 by the GROMACS development team.
-# Copyright (c) 2019,2020, by the GROMACS development team, led by
+# Copyright (c) 2019,2020,2021, by the GROMACS development team, led by
 # Mark Abraham, David van der Spoel, Berk Hess, and Erik Lindahl,
 # and including many others, as listed in the AUTHORS file in the
 # top-level source directory and at http://www.gromacs.org.
@@ -33,6 +33,8 @@
 # To help us fund GROMACS development, we humbly ask that you cite
 # the research papers on the package. Check out http://www.gromacs.org.
 
+# Set up the module library
+add_library(ewald INTERFACE)
 gmx_add_libgromacs_sources(
     calculate_spline_moduli.cpp
     ewald.cpp
@@ -58,7 +60,6 @@ if (GMX_GPU_CUDA)
     gmx_add_libgromacs_sources(
         # CUDA-specific sources
         pme_gather.cu
-        pme_gpu_3dfft.cu
         pme_solve.cu
         pme_spread.cu
         pme_gpu_program_impl.cu
@@ -74,11 +75,10 @@ if (GMX_GPU_CUDA)
         # Must add these files so they can include device_information.h
         pme_gpu_internal.cpp
         pme_gpu_timings.cpp
-       )
+        )
 elseif (GMX_GPU_OPENCL)
     gmx_add_libgromacs_sources(
         # OpenCL-specific sources
-        pme_gpu_3dfft_ocl.cpp
         pme_gpu_program_impl_ocl.cpp
         # GPU-specific sources
         pme_gpu.cpp
@@ -86,14 +86,26 @@ elseif (GMX_GPU_OPENCL)
         pme_gpu_timings.cpp
         )
 elseif (GMX_GPU_SYCL)
-    # SYCL-TODO: proper implementation
     gmx_add_libgromacs_sources(
-        pme_gpu_program_impl.cpp
+        # GPU-specific sources
+        pme_gather_sycl.cpp
+        pme_gpu.cpp
+        pme_gpu_internal.cpp
+        pme_gpu_program_impl_sycl.cpp
+        pme_gpu_timings.cpp
+        pme_solve_sycl.cpp
+        pme_spread_sycl.cpp
         )
     _gmx_add_files_to_property(SYCL_SOURCES
-        pme_gpu_program_impl.cpp
+        pme_gather_sycl.cpp
+        pme_gpu_internal.cpp
         pme_gpu_program.cpp
-        )
+        pme_gpu_program_impl_sycl.cpp
+        pme_gpu_3dfft_sycl.cpp
+        pme_gpu_timings.cpp
+        pme_solve_sycl.cpp
+        pme_spread_sycl.cpp
+      )
 else()
     gmx_add_libgromacs_sources(
         # Files that implement stubs
@@ -101,6 +113,38 @@ else()
         )
 endif()
 
+# Source files have the following private module dependencies.
+target_link_libraries(ewald PRIVATE
+                      #                      gmxlib
+                      #                      math
+                      #                      mdtypes
+                      #                      tng_io
+                      )
+
+# Public interface for modules, including dependencies and interfaces
+#target_include_directories(ewald PUBLIC
+target_include_directories(ewald INTERFACE
+                           $<BUILD_INTERFACE:${CMAKE_CURRENT_SOURCE_DIR}/include>)
+#target_link_libraries(ewald PUBLIC
+target_link_libraries(ewald INTERFACE
+                      legacy_api
+                      )
+
+# TODO: when fileio is an OBJECT target
+#target_link_libraries(ewald PUBLIC legacy_api)
+#target_link_libraries(ewald PRIVATE common)
+
+# Module dependencies
+# This module convey transitive dependence on these modules.
+#target_link_libraries(ewald PUBLIC
+target_link_libraries(ewald INTERFACE
+                      #                      utility
+                      )
+# Source files have the following private module dependencies.
+#target_link_libraries(ewald PRIVATE tng_io)
+# TODO: Explicitly link specific modules.
+#target_link_libraries(ewald PRIVATE legacy_modules)
+
 if (BUILD_TESTING)
     add_subdirectory(tests)
 endif()