CMakeLists.txt 7.64 KB
Newer Older
Mark Friedrichs's avatar
Mark Friedrichs committed
1
2
3
#---------------------------------------------------
# OpenMM Amoeba Plugin
#
4
# Creates OpenMMAmoeba plugin library.
Mark Friedrichs's avatar
Mark Friedrichs committed
5
6
#
# Windows:
7
8
9
#   OpenMMAmoeba.dll
#   OpenMMAmoeba.lib
#   OpenMMAmoeba_static.lib
Mark Friedrichs's avatar
Mark Friedrichs committed
10
# Unix:
11
12
#   libOpenMMAmoeba.so
#   libOpenMMAmoeba_static.a
Mark Friedrichs's avatar
Mark Friedrichs committed
13
14
15
16
17
18
#----------------------------------------------------

#INCLUDE(Dart)

# The source is organized into subdirectories, but we handle them all from
# this CMakeLists file rather than letting CMake visit them as SUBDIRS.
19
SET(OPENMM_AMOEBA_PLUGIN_SOURCE_SUBDIRS . openmmapi serialization)
Mark Friedrichs's avatar
Mark Friedrichs committed
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42

# Collect up information about the version of the OpenMM library we're building
# and make it available to the code so it can be built into the binaries.

SET(OPENMM_AMOEBA_LIBRARY_NAME OpenMMAmoeba)
SET(OPENMM_AMOEBA_MAJOR_VERSION 1)
SET(OPENMM_AMOEBA_MINOR_VERSION 0)
SET(OPENMM_AMOEBA_BUILD_VERSION 0)

ADD_DEFINITIONS(-DOPENMM_AMOEBA_LIBRARY_NAME=${OPENMM_AMOEBA_LIBRARY_NAME}
                -DOPENMM_AMOEBA_MAJOR_VERSION=${OPENMM_AMOEBA_MAJOR_VERSION}
                -DOPENMM_AMOEBA_MINOR_VERSION=${OPENMM_AMOEBA_MINOR_VERSION}
		          -DOPENMM_AMOEBA_BUILD_VERSION=${OPENMM_AMOEBA_BUILD_VERSION})

SET(SHARED_AMOEBA_TARGET ${OPENMM_AMOEBA_LIBRARY_NAME})
SET(STATIC_AMOEBA_TARGET ${OPENMM_AMOEBA_LIBRARY_NAME}_static)

# These are all the places to search for header files which are
# to be part of the API.
SET(API_AMOEBA_INCLUDE_DIRS) # start empty
FOREACH(subdir ${OPENMM_AMOEBA_PLUGIN_SOURCE_SUBDIRS})
    # append
    SET(API_AMOEBA_INCLUDE_DIRS ${API_AMOEBA_INCLUDE_DIRS}
43
                                     ${CMAKE_CURRENT_SOURCE_DIR}/${subdir}/include
Mark Friedrichs's avatar
Mark Friedrichs committed
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
                                     ${CMAKE_CURRENT_SOURCE_DIR}/${subdir}/include/internal)
ENDFOREACH(subdir)

# We'll need both *relative* path names, starting with their API_INCLUDE_DIRS,
# and absolute pathnames.
SET(API_AMOEBA_REL_INCLUDE_FILES)   # start these out empty
SET(API_AMOEBA_ABS_INCLUDE_FILES)

FOREACH(dir ${API_AMOEBA_INCLUDE_DIRS})
    FILE(GLOB fullpaths ${dir}/*.h)	# returns full pathnames
    SET(API_AMOEBA_ABS_INCLUDE_FILES ${API_AMOEBA_ABS_INCLUDE_FILES} ${fullpaths})

    FOREACH(pathname ${fullpaths})
        GET_FILENAME_COMPONENT(filename ${pathname} NAME)
        SET(API_AMOEBA_REL_INCLUDE_FILES ${API_AMOEBA_REL_INCLUDE_FILES} ${dir}/${filename})
    ENDFOREACH(pathname)
ENDFOREACH(dir)

# collect up source files
SET(SOURCE_AMOEBA_FILES) # empty
SET(SOURCE_AMOEBA_INCLUDE_FILES)

FOREACH(subdir ${OPENMM_AMOEBA_PLUGIN_SOURCE_SUBDIRS})
    FILE(GLOB src_files  ${CMAKE_CURRENT_SOURCE_DIR}/${subdir}/src/*.cpp ${CMAKE_CURRENT_SOURCE_DIR}/${subdir}/src/*/*.cpp)
    FILE(GLOB incl_files ${CMAKE_CURRENT_SOURCE_DIR}/${subdir}/src/*.h)
    SET(SOURCE_AMOEBA_FILES         ${SOURCE_AMOEBA_FILES}         ${src_files})   #append
    SET(SOURCE_AMOEBA_INCLUDE_FILES ${SOURCE_AMOEBA_INCLUDE_FILES} ${incl_files})

    ## Make sure we find these locally before looking in OpenMM/include if
    ## OpenMM was previously installed there.
    INCLUDE_DIRECTORIES(BEFORE ${CMAKE_CURRENT_SOURCE_DIR}/${subdir}/include)
ENDFOREACH(subdir)

# ----------------------------------------------------------------------------

# If API_AMOEBA wrappers are being generated, and add them to the build.
Mark Friedrichs's avatar
Mark Friedrichs committed
80
IF(OPENMM_BUILD_C_AND_FORTRAN_WRAPPERS)
81
82
83
    ADD_SUBDIRECTORY(wrappers)
    SET(SOURCE_AMOEBA_FILES ${SOURCE_AMOEBA_FILES} wrappers/AmoebaOpenMMCWrapper.cpp  wrappers/AmoebaOpenMMFortranWrapper.cpp)
    SET_SOURCE_FILES_PROPERTIES(wrappers/AmoebaOpenMMCWrapper.cpp wrappers/AmoebaOpenMMFortranWrapper.cpp PROPERTIES GENERATED TRUE)
Mark Friedrichs's avatar
Mark Friedrichs committed
84
ENDIF(OPENMM_BUILD_C_AND_FORTRAN_WRAPPERS)
Mark Friedrichs's avatar
Mark Friedrichs committed
85
86
87
88

INCLUDE_DIRECTORIES(BEFORE ${CMAKE_CURRENT_SOURCE_DIR}/src)

ADD_LIBRARY(${SHARED_AMOEBA_TARGET} SHARED ${SOURCE_AMOEBA_FILES} ${SOURCE_AMOEBA_INCLUDE_FILES} ${API_AMOEBA_ABS_INCLUDE_FILES})
89
SET_TARGET_PROPERTIES(${SHARED_AMOEBA_TARGET} PROPERTIES LINK_FLAGS "${EXTRA_LINK_FLAGS}" COMPILE_FLAGS "${EXTRA_COMPILE_FLAGS} -DOPENMM_AMOEBA_BUILDING_SHARED_LIBRARY -DLEPTON_BUILDING_SHARED_LIBRARY")
Mark Friedrichs's avatar
Mark Friedrichs committed
90

91
92
FILE(GLOB serialization_files  ${CMAKE_CUURENT_SOURCE_DIR}/serialization/src/*.cpp)
SET_SOURCE_FILES_PROPERTIES(${serialization_files} PROPERTIES COMPILE_FLAGS "-DOPENMM_AMOEBA_BUILDING_SHARED_LIBRARY -DTIXML_USE_STL")
93

Mark Friedrichs's avatar
Mark Friedrichs committed
94
95
IF(OPENMM_BUILD_STATIC_LIB)
  ADD_LIBRARY(${STATIC_AMOEBA_TARGET} STATIC ${SOURCE_AMOEBA_FILES} ${SOURCE_AMOEBA_INCLUDE_FILES} ${API_AMOEBA_ABS_INCLUDE_FILES})
96
  SET_TARGET_PROPERTIES(${STATIC_AMOEBA_TARGET} PROPERTIES LINK_FLAGS "${EXTRA_LINK_FLAGS}" COMPILE_FLAGS "${EXTRA_COMPILE_FLAGS} -DOPENMM_AMOEBA_BUILDING_STATIC_LIBRARY -DOPENMM_USE_STATIC_LIBRARIES -DOPENMM_BUILDING_STATIC_LIBRARY -DLEPTON_USE_STATIC_LIBRARIES -DLEPTON_BUILDING_STATIC_LIBRARY")
Mark Friedrichs's avatar
Mark Friedrichs committed
97
98
ENDIF(OPENMM_BUILD_STATIC_LIB)

Mark Friedrichs's avatar
Mark Friedrichs committed
99
IF(OPENMM_BUILD_C_AND_FORTRAN_WRAPPERS)
100
101
102
103
    ADD_DEPENDENCIES(${SHARED_AMOEBA_TARGET} AmoebaApiWrappers)
    IF(OPENMM_BUILD_STATIC_LIB)
        ADD_DEPENDENCIES(${STATIC_AMOEBA_TARGET} AmoebaApiWrappers)
    ENDIF(OPENMM_BUILD_STATIC_LIB)
Mark Friedrichs's avatar
Mark Friedrichs committed
104
ENDIF(OPENMM_BUILD_C_AND_FORTRAN_WRAPPERS)
105
106

# ----------------------------------------------------------------------------
Mark Friedrichs's avatar
Mark Friedrichs committed
107
108
109
110
111
112
113
114
115
116
117

# On Linux need to link to libdl
FIND_LIBRARY(DL_LIBRARY dl)
IF(DL_LIBRARY)
  TARGET_LINK_LIBRARIES(${SHARED_AMOEBA_TARGET} ${DL_LIBRARY})
  IF(OPENMM_BUILD_STATIC_LIB)
    TARGET_LINK_LIBRARIES(${STATIC_AMOEBA_TARGET} ${DL_LIBRARY})
  ENDIF(OPENMM_BUILD_STATIC_LIB)
ENDIF(DL_LIBRARY)

SET( OpenMMLib OpenMM )
118

Mark Friedrichs's avatar
Mark Friedrichs committed
119
120
TARGET_LINK_LIBRARIES( ${SHARED_AMOEBA_TARGET} ${SHARED_TARGET} )
IF(OPENMM_BUILD_STATIC_LIB)
121
    TARGET_LINK_LIBRARIES( ${STATIC_AMOEBA_TARGET} ${STATIC_TARGET} )
Mark Friedrichs's avatar
Mark Friedrichs committed
122
123
124
ENDIF(OPENMM_BUILD_STATIC_LIB)

# Which hardware platforms to build
125
126

ADD_SUBDIRECTORY(platforms/reference)
127
ADD_SUBDIRECTORY(platforms/common)
128

129
IF(OPENMM_BUILD_CUDA_LIB)
Mark Friedrichs's avatar
Mark Friedrichs committed
130
    SET(OPENMM_BUILD_AMOEBA_CUDA_LIB ON CACHE BOOL "Build OpenMMAmoebaCuda library for Nvidia GPUs")
131
ELSE(OPENMM_BUILD_CUDA_LIB)
Mark Friedrichs's avatar
Mark Friedrichs committed
132
    SET(OPENMM_BUILD_AMOEBA_CUDA_LIB OFF CACHE BOOL "Build OpenMMAmoebaCuda library for Nvidia GPUs")
133
ENDIF(OPENMM_BUILD_CUDA_LIB)
Mark Friedrichs's avatar
Mark Friedrichs committed
134

135
136
137
138
139
140
IF(OPENMM_BUILD_OPENCL_LIB)
    SET(OPENMM_BUILD_AMOEBA_OPENCL_LIB ON CACHE BOOL "Build OpenMMAmoebaOpenCL library")
ELSE(OPENMM_BUILD_OPENCL_LIB)
    SET(OPENMM_BUILD_AMOEBA_OPENCL_LIB OFF CACHE BOOL "Build OpenMMAmoebaOpenCL library")
ENDIF(OPENMM_BUILD_OPENCL_LIB)

Mark Friedrichs's avatar
Mark Friedrichs committed
141
142
143
144
145
146
147
SET(OPENMM_BUILD_AMOEBA_CUDA_PATH)
IF(OPENMM_BUILD_AMOEBA_CUDA_LIB)
    ADD_SUBDIRECTORY(platforms/cuda)
    SET(OPENMM_BUILD_AMOEBA_CUDA_PATH ${CMAKE_CURRENT_SOURCE_DIR}/platforms/cuda)
    SET(OPENMM_AMOEBA_CUDA_SOURCE_SUBDIRS . openmmapi olla platforms/cuda)
ENDIF(OPENMM_BUILD_AMOEBA_CUDA_LIB)

148
149
150
151
152
153
154
SET(OPENMM_BUILD_AMOEBA_OPENCL_PATH)
IF(OPENMM_BUILD_AMOEBA_OPENCL_LIB)
    ADD_SUBDIRECTORY(platforms/opencl)
    SET(OPENMM_BUILD_AMOEBA_OPENCL_PATH ${CMAKE_CURRENT_SOURCE_DIR}/platforms/opencl)
    SET(OPENMM_AMOEBA_OPENCL_SOURCE_SUBDIRS . openmmapi olla platforms/opencl)
ENDIF(OPENMM_BUILD_AMOEBA_OPENCL_LIB)

155
INSTALL_TARGETS(/lib RUNTIME_DIRECTORY /lib ${SHARED_AMOEBA_TARGET})
Mark Friedrichs's avatar
Mark Friedrichs committed
156
IF(OPENMM_BUILD_STATIC_LIB)
157
  INSTALL_TARGETS(/lib RUNTIME_DIRECTORY /lib ${STATIC_AMOEBA_TARGET})
Mark Friedrichs's avatar
Mark Friedrichs committed
158
159
160
161
162
163
164
165
166
167
168
169
170
171
172
173
174
175
176
177
ENDIF(OPENMM_BUILD_STATIC_LIB)
FILE(GLOB CORE_HEADERS     include/*.h          */include/*.h)
FILE(GLOB TOP_HEADERS      include/openmm/*.h          */include/openmm/*.h)
FILE(GLOB INTERNAL_HEADERS include/openmm/internal/*.h */include/openmm/internal/*.h )
INSTALL_FILES(/include                 FILES ${CORE_HEADERS})
INSTALL_FILES(/include/openmm          FILES ${TOP_HEADERS})
INSTALL_FILES(/include/openmm/internal FILES ${INTERNAL_HEADERS})

#
# Testing
#

ENABLE_TESTING()

IF (EXECUTABLE_OUTPUT_PATH)
  SET (TEST_PATH ${EXECUTABLE_OUTPUT_PATH})
ELSE (EXECUTABLE_OUTPUT_PATH)
  SET (TEST_PATH .)
ENDIF (EXECUTABLE_OUTPUT_PATH)

178
IF(BUILD_TESTING AND OPENMM_BUILD_SERIALIZATION_TESTS)
179
    ADD_SUBDIRECTORY(serialization/tests)
180
ENDIF(BUILD_TESTING AND OPENMM_BUILD_SERIALIZATION_TESTS)