source: src/Makefile.am@ f433ec

# PLEASE adhere to the alphabetical ordering in this Makefile!
# Also indentation by a single tab

MOSTLYCLEANFILES =
lib_LTLIBRARIES =
noinst_LTLIBRARIES =
BUILT_SOURCES =
bin_PROGRAMS =
EXTRA_DIST =

# libMolecuilder.la requires the libraries listed below

include Geometry/Makefile.am
include Helpers/Makefile.am
include Shapes/Makefile.am
include Tesselation/Makefile.am

# then comes the library itself

AM_LDFLAGS = -ldl ${BOOST_LDFLAGS} ${CodePatterns_LDFLAGS} ${JobMarket_LDFLAGS} $(LEVMAR_LDFLAGS)
AM_CPPFLAGS = \
        -I$(top_srcdir)/src/unittests \
        -I$(top_srcdir)/src/Actions \
        -I$(top_srcdir)/src/UIElements \
        -I$(top_srcdir)/ThirdParty/LinearAlgebra/src \
        $(LEVMAR_CPPFLAGS) \
        ${BOOST_CPPFLAGS} \
        ${CodePatterns_CFLAGS}


BONDSOURCE = \
        Bond/bond.cpp \
        Bond/bond_observable.cpp \
        Bond/BondInfo.cpp \
        Bond/GraphEdge.cpp

BONDHEADER = \
        Bond/bond.hpp \
        Bond/bond_observable.hpp \
        Bond/BondInfo.hpp \
        Bond/GraphEdge.hpp

DESCRIPTORSOURCE = \
  Descriptors/AtomDescriptor.cpp \
  Descriptors/AtomIdDescriptor.cpp \
  Descriptors/AtomNameDescriptor.cpp \
  Descriptors/AtomOfMoleculeDescriptor.cpp \
  Descriptors/AtomOfMoleculeSelectionDescriptor.cpp \
  Descriptors/AtomOrderDescriptor.cpp \
  Descriptors/AtomSelectionDescriptor.cpp \
  Descriptors/AtomShapeDescriptor.cpp \
  Descriptors/AtomTypeDescriptor.cpp \
  Descriptors/AtomsWithinDistanceOfDescriptor.cpp \
  Descriptors/MoleculeDescriptor.cpp \
  Descriptors/MoleculeFormulaDescriptor.cpp \
  Descriptors/MoleculeIdDescriptor.cpp \
  Descriptors/MoleculeNameDescriptor.cpp \
  Descriptors/MoleculeOfAtomSelectionDescriptor.cpp \
  Descriptors/MoleculeOrderDescriptor.cpp \
  Descriptors/MoleculePtrDescriptor.cpp \
  Descriptors/MoleculeSelectionDescriptor.cpp
                                   

DESCRIPTORHEADER = \
  Descriptors/AtomDescriptor.hpp \
  Descriptors/AtomIdDescriptor.hpp \
  Descriptors/AtomNameDescriptor.hpp \
  Descriptors/AtomOfMoleculeDescriptor.hpp \
  Descriptors/AtomOfMoleculeSelectionDescriptor.hpp \
  Descriptors/AtomOrderDescriptor.hpp \
  Descriptors/AtomSelectionDescriptor.hpp \
  Descriptors/AtomShapeDescriptor.hpp \
  Descriptors/AtomTypeDescriptor.hpp \
  Descriptors/AtomsWithinDistanceOfDescriptor.hpp \
  Descriptors/DescriptorBase.hpp \
  Descriptors/MoleculeDescriptor.hpp \
  Descriptors/MoleculeFormulaDescriptor.hpp \
  Descriptors/MoleculeIdDescriptor.hpp \
  Descriptors/MoleculeNameDescriptor.hpp \
  Descriptors/MoleculeOfAtomSelectionDescriptor.hpp \
  Descriptors/MoleculeOrderDescriptor.hpp \
  Descriptors/MoleculePtrDescriptor.hpp \
  Descriptors/MoleculeSelectionDescriptor.hpp \
  Descriptors/SelectiveConstIterator.hpp \
  Descriptors/SelectiveIterator.hpp
  
DESCRIPTORIMPLHEADER = \
  Descriptors/AtomDescriptor_impl.hpp \
  Descriptors/AtomIdDescriptor_impl.hpp \
  Descriptors/AtomNameDescriptor_impl.hpp \
  Descriptors/AtomOfMoleculeDescriptor_impl.hpp \
  Descriptors/AtomOfMoleculeSelectionDescriptor_impl.hpp \
  Descriptors/AtomOrderDescriptor_impl.hpp \
  Descriptors/AtomSelectionDescriptor_impl.hpp \
  Descriptors/AtomShapeDescriptor_impl.hpp \
  Descriptors/AtomTypeDescriptor_impl.hpp \
  Descriptors/AtomsWithinDistanceOfDescriptor_impl.hpp \
  Descriptors/DescriptorBase_impl.hpp \
  Descriptors/MoleculeDescriptor_impl.hpp \
  Descriptors/MoleculeFormulaDescriptor_impl.hpp \
  Descriptors/MoleculeIdDescriptor_impl.hpp \
  Descriptors/MoleculeNameDescriptor_impl.hpp \
  Descriptors/MoleculeOfAtomSelectionDescriptor_impl.hpp \
  Descriptors/MoleculeOrderDescriptor_impl.hpp \
  Descriptors/MoleculePtrDescriptor_impl.hpp \
  Descriptors/MoleculeSelectionDescriptor_impl.hpp \
  Descriptors/SelectiveConstIterator_impl.hpp \
  Descriptors/SelectiveIterator_impl.hpp

DYNAMICSSOURCE = \
        Dynamics/BondVectors.cpp \
        Dynamics/MinimiseConstrainedPotential.cpp

DYNAMICSHEADER = \
        Dynamics/AtomicForceManipulator.hpp \
        Dynamics/BondVectors.hpp \
        Dynamics/BondVectors_impl.hpp \
        Dynamics/ForceAnnealing.hpp \
        Dynamics/LinearInterpolationBetweenSteps.hpp \
        Dynamics/MinimiseConstrainedPotential.hpp \
        Dynamics/OutputTemperature.hpp \
        Dynamics/VerletForceIntegration.hpp

THERMOSTATSOURCE = \
  Thermostats/Berendsen.cpp \
  Thermostats/GaussianThermostat.cpp \
  Thermostats/Langevin.cpp \
  Thermostats/NoseHoover.cpp \
  Thermostats/NoThermostat.cpp \
  Thermostats/Thermostat.cpp \
  Thermostats/ThermoStatContainer.cpp \
  Thermostats/Woodcock.cpp

THERMOSTATHEADER = \
  Thermostats/Berendsen.hpp \
  Thermostats/GaussianThermostat.hpp \
  Thermostats/Langevin.hpp \
  Thermostats/NoseHoover.hpp \
  Thermostats/NoThermostat.hpp \
  Thermostats/Thermostat.hpp \
  Thermostats/ThermoStatContainer.hpp \
  Thermostats/Woodcock.hpp

MOLECUILDERSOURCE = \
  ${BONDSOURCE} \
  ${DESCRIPTORSOURCE} \
  ${DYNAMICSSOURCE} \
  ${THERMOSTATSOURCE} \
  Shapes/ShapeFactory.cpp \
  AtomIdSet.cpp \
  Box.cpp \
  Box_BoundaryConditions.cpp \
  config.cpp \
  Formula.cpp \
  MoleculeLeafClass.cpp \
  MoleculeObserver.cpp \
  molecule.cpp \
  molecule_geometry.cpp \
  molecule_graph.cpp \
  UIElements/UIFactory.cpp \
  version.c \
  World.cpp \
  WorldTime.cpp

MOLECUILDERHEADER = \
  ${BONDHEADER} \
  ${DESCRIPTORHEADER} \
  ${DESCRIPTORIMPLHEADER} \
  ${DYNAMICSHEADER} \
  ${THERMOSTATHEADER} \
  Shapes/ShapeFactory.hpp \
  AtomIdSet.hpp \
  Box.hpp \
  Box_BoundaryConditions.hpp \
  config.hpp \
  EntityObserver.hpp \
  EntityObserver_impl.hpp \
  Formula.hpp \
  IdPool.hpp \
  IdPool_impl.hpp \
  IdPool_policy.hpp \
  MoleculeLeafClass.hpp \
  MoleculeObserver.hpp \
  molecule.hpp \
  types.hpp \
  ThreadGuard.hpp \
  UIElements/UIFactory.hpp \
  version.h \
  World.hpp \
  World_calculations.hpp \
  WorldTime.hpp

lib_LTLIBRARIES += libMolecuilder.la
libMolecuilder_la_includedir = $(includedir)/MoleCuilder/
libMolecuilder_la_LDFLAGS = \
        $(AM_LDFLAGS) \
        $(BOOST_SYSTEM_LDFLAGS) \
        $(BOOST_THREAD_LDFLAGS)
libMolecuilder_la_LIBADD = \
        libMolecuilderTesselation.la \
        libMolecuilderShapes.la \
        libMolecuilderHelpers.la \
        $(top_builddir)/ThirdParty/LinearAlgebra/src/LinearAlgebra/libLinearAlgebra.la \
        ${CodePatterns_LIBS} \
        $(BOOST_SERIALIZATION_LIBS) \
        $(BOOST_PROGRAM_OPTIONS_LIBS) \
        $(BOOST_FILESYSTEM_LIBS) \
        $(BOOST_SYSTEM_LIBS) \
        $(BOOST_THREAD_LIBS)

nobase_libMolecuilder_la_include_HEADERS = ${MOLECUILDERHEADER}

## Define the source file list for the "libexample-@MOLECUILDER_API_VERSION@.la"
## target.  Note that @MOLECUILDER_API_VERSION@ is not interpreted by Automake and
## will therefore be treated as if it were literally part of the target name,
## and the variable name derived from that.
## The file extension .cc is recognized by Automake, and makes it produce
## rules which invoke the C++ compiler to produce a libtool object file (.lo)
## from each source file.  Note that it is not necessary to list header files
## which are already listed elsewhere in a _HEADERS variable assignment.
libMolecuilder_la_SOURCES = ${MOLECUILDERSOURCE}

## Instruct libtool to include ABI version information in the generated shared
## library file (.so).  The library ABI version is defined in configure.ac, so
## that all version information is kept in one place.
libMolecuilder_la_LDFLAGS += -version-info $(MOLECUILDER_SO_VERSION)

## The generated configuration header is installed in its own subdirectory of
## $(libdir).  The reason for this is that the configuration information put
## into this header file describes the target platform the installed library
## has been built for.  Thus the file must not be installed into a location
## intended for architecture-independent files, as defined by the Filesystem
## Hierarchy Standard (FHS).
## The nodist_ prefix instructs Automake to not generate rules for including
## the listed files in the distribution on 'make dist'.  Files that are listed
## in _HEADERS variables are normally included in the distribution, but the
## configuration header file is generated at configure time and should not be
## shipped with the source tarball.
libMolecuilder_la_libincludedir = $(libdir)/MoleCuilder/include
nodist_libMolecuilder_la_libinclude_HEADERS = $(top_builddir)/libmolecuilder_config.h

## Install the generated pkg-config file (.pc) into the expected location for
## architecture-dependent package configuration information.  Occasionally,
## pkg-config files are also used for architecture-independent data packages,
## in which case the correct install location would be $(datadir)/pkgconfig.
pkgconfigdir = $(libdir)/pkgconfig
pkgconfig_DATA = $(top_builddir)/MoleCuilder.pc

# then we compile the remainder of all other libraries, especially
# libMolecuilderUI.la, which requires libMolecuilder.la on install

include Actions/Makefile.am
include Analysis/Makefile.am
include Atom/Makefile.am
include Element/Makefile.am
include Filling/Makefile.am
include Fragmentation/Makefile.am
include Fragmentation/Automation/Makefile.am
include Fragmentation/Summation/Containers/Makefile.am
include Fragmentation/Summation/Converter/Makefile.am
include Fragmentation/Summation/Makefile.am
include Fragmentation/Summation/SetValues/Makefile.am
include FunctionApproximation/Makefile.am
include Graph/Makefile.am
include Jobs/Makefile.am

if CONDPYTHON
include Python/Makefile.am
endif

include LinkedCell/Makefile.am
include Parameters/Makefile.am
include Parser/Makefile.am
include Potentials/Makefile.am
include RandomNumbers/Makefile.am
include UIElements/Makefile.am

bin_PROGRAMS += molecuilder 
EXTRA_PROGRAMS = unity


extrastuffdir = $(datadir)/@PACKAGE@/data
databasedir = $(extrastuffdir)/databases
database_DATA = \
        ${top_srcdir}/data/databases/*.db

bondtabledir = $(extrastuffdir)/bondtables
bondtable_DATA = \
        ${top_srcdir}/data/bondtables/*.dat

moleculedir = $(extrastuffdir)/molecules
molecule_DATA = \
        ${top_srcdir}/data/molecules/*.pdb


molecuilder_CPPFLAGS  = $(AM_CPPFLAGS)
#molecuilder_CPPFLAGS += -DNO_CACHING
molecuilder_LDFLAGS = \
        $(AM_LDFLAGS) \
        $(BOOST_FILESYSTEM_LDFLAGS) \
        $(BOOST_PROGRAM_OPTIONS_LDFLAGS) \
        $(BOOST_RANDOM_LDFLAGS) \
        $(BOOST_SYSTEM_LDFLAGS) \
        $(BOOST_THREAD_LDFLAGS)
molecuilder_SOURCES = \
        builder.cpp \
        builder_init.cpp \
        builder_init.hpp \
        Python/PythonScripting.hpp
molecuilder_LDADD = \
        libMolecuilder.la \
        libMolecuilderUI.la
molecuilder_LDADD += \
        ${CodePatterns_LIBS} \
        $(BOOST_THREAD_LIBS) \
        $(BOOST_PROGRAM_OPTIONS_LIBS) \
        $(BOOST_RANDOM_LIBS) \
        $(BOOST_FILESYSTEM_LIBS) \
        $(BOOST_SYSTEM_LIBS)
        
if CONDPYTHON
molecuilder_SOURCES += \
        Actions/Action_impl_python.hpp \
        Actions/GlobalListOfActions.hpp
molecuilder_CPPFLAGS += -I$(PYTHON_INCLUDE_DIR)
molecuilder_LDFLAGS += $(BOOST_PYTHON_LDFLAGS) 
molecuilder_LDADD += \
        $(BOOST_PYTHON_LIBS) \
        ${CodePatterns_LIBS} \
        -l$(PYTHON_LIB)
endif

#Stuff for building the GUI using Qt
if CONDQTGUI
bin_PROGRAMS += molecuildergui
molecuildergui_SOURCES = \
        builder.cpp \
        builder_init.cpp \
        builder_init.hpp \
        Python/PythonScripting.hpp
molecuildergui_CPPFLAGS = $(AM_CPPFLAGS) -DUSE_GUI_QT
molecuildergui_LDFLAGS = \
        $(AM_LDFLAGS) \
        $(BOOST_FILESYSTEM_LDFLAGS) \
        $(BOOST_PROGRAM_OPTIONS_LDFLAGS) \
        $(BOOST_SYSTEM_LDFLAGS) \
        $(BOOST_THREAD_LDFLAGS)
molecuildergui_LDADD = \
        libMolecuilder.la \
        libMolecuilderQtUI.la \
        libMolecuilderUI.la
molecuildergui_LDADD += \
        ${CodePatterns_LIBS} \
        $(BOOST_THREAD_LIBS) \
        $(BOOST_PROGRAM_OPTIONS_LIBS) \
        $(BOOST_RANDOM_LIBS) \
        $(BOOST_FILESYSTEM_LIBS) \
        $(BOOST_SYSTEM_LIBS) \
        $(GUI_LIBS)

if CONDPYTHON
molecuildergui_SOURCES += \
        Actions/Action_impl_python.hpp \
        Actions/GlobalListOfActions.hpp
molecuildergui_CPPFLAGS += -I$(PYTHON_INCLUDE_DIR)
molecuildergui_LDFLAGS += $(BOOST_PYTHON_LDFLAGS) 
molecuildergui_LDADD += \
        $(BOOST_PYTHON_LIBS) \
        ${CodePatterns_LIBS} \
        -l$(PYTHON_LIB)
endif

endif

if CONDJOBMARKET
CONTROLLERSOURCE = \
        controller_MPQCCommandJob.cpp \
        ControllerOptions_MPQCCommandJob.cpp

CONTROLLERHEADER = \
        controller_MPQCCommandJob.hpp \
        ControllerOptions_MPQCCommandJob.hpp


noinst_LTLIBRARIES += libFragmentationAutomationController.la
libFragmentationAutomationController_la_includedir = $(includedir)/MoleCuilder/JobMarket
nobase_libFragmentationAutomationController_la_include_HEADERS = $(CONTROLLERHEADER)
libFragmentationAutomationController_la_SOURCES = $(CONTROLLERSOURCE)
 libFragmentationAutomationController_la_CPPFLAGS = $(AM_CPPFLAGS) $(JobMarket_CFLAGS)
libFragmentationAutomationController_la_LIBADD = \
        ${JobMarket_Controller_LIBS} \
        $(JobMarket_LIBS)

bin_PROGRAMS += molecuilder_controller molecuilder_poolworker molecuilder_server

molecuilder_controller_SOURCES = controller.cpp controller_AddOn_MPQCCommandJob.cpp
molecuilder_controller_LDFLAGS = $(AM_LDFLAGS) $(BOOST_SERIALIZATION_LDFLAGS) $(BOOST_PROGRAM_OPTIONS_LDFLAGS)
molecuilder_controller_CPPFLAGS = $(AM_CPPFLAGS) $(JobMarket_CFLAGS)
molecuilder_controller_LDADD = \
        libFragmentationAutomationController.la \
        libMolecuilderFragmentation_getFromKeysetStub.la \
        libMolecuilderFragmentation.la \
        libMolecuilderJobs.la \
        libMolecuilderJobs_Work.la \
        libMolecuilderFragmentationSummation.la \
        libMolecuilderFragmentation_KeysetsContainer.la \
        libMolecuilderHelpers.la \
        $(JobMarket_Controller_LIBS) \
        $(top_builddir)/ThirdParty/LinearAlgebra/src/LinearAlgebra/libLinearAlgebra.la \
        $(BOOST_SERIALIZATION_LIBS) \
        $(BOOST_PROGRAM_OPTIONS_LIBS) \
        ${CodePatterns_LIBS}

molecuilder_poolworker_SOURCES = poolworker.cpp 
molecuilder_poolworker_LDFLAGS = $(AM_LDFLAGS) $(BOOST_SERIALIZATION_LDFLAGS) $(BOOST_PROGRAM_OPTIONS_LDFLAGS)
molecuilder_poolworker_CPPFLAGS = \
        $(AM_CPPFLAGS) $(JobMarket_CFLAGS) \
        -I$(top_builddir)/ThirdParty/mpqc_open/src/lib \
        -I$(top_srcdir)/ThirdParty/mpqc_open/src/lib \
        -I$(top_srcdir)/ThirdParty/mpqc_open/src/bin/mpqc

molecuilder_poolworker_LDADD = \
        libMolecuilderJobs.la \
        libMolecuilderJobs_Work.la \
        libMolecuilderFragmentationSummation.la \
        ${JobMarket_PoolWorker_LIBS} \
        $(top_builddir)/ThirdParty/LinearAlgebra/src/LinearAlgebra/libLinearAlgebra.la \
        $(BOOST_SERIALIZATION_LIBS) \
        $(BOOST_PROGRAM_OPTIONS_LIBS) \
        ${CodePatterns_LIBS}

molecuilder_server_SOURCES = Server.cpp 
molecuilder_server_LDFLAGS = $(AM_LDFLAGS) $(BOOST_SERIALIZATION_LDFLAGS) $(BOOST_PROGRAM_OPTIONS_LDFLAGS)
molecuilder_server_CPPFLAGS = $(AM_CPPFLAGS) $(JobMarket_CFLAGS)
molecuilder_server_LDADD = \
        libMolecuilderJobs.la \
        libMolecuilderJobs_Work.la \
        libMolecuilderFragmentationSummation.la \
        ${JobMarket_Server_LIBS} \
        $(top_builddir)/ThirdParty/LinearAlgebra/src/LinearAlgebra/libLinearAlgebra.la \
        $(BOOST_SERIALIZATION_LIBS) \
        $(BOOST_PROGRAM_OPTIONS_LIBS) \
        ${CodePatterns_LIBS}
endif

unity_SOURCES = unity.cpp
unity_CPPFLAGS = $(AM_CPPFLAGS) 
unity_LDFLAGS = $(AM_LDFLAGS) $(BOOST_FILESYSTEM_LDFLAGS) $(BOOST_PROGRAM_OPTIONS_LDFLAGS) $(BOOST_RANDOM_LDFLAGS) $(BOOST_SYSTEM_LDFLAGS) $(BOOST_THREAD_LDFLAGS)
unity_LDADD = \
        ${CodePatterns_LIBS} \
        $(BOOST_THREAD_LIBS) \
        $(BOOST_PROGRAM_OPTIONS_LIBS) \
        $(BOOST_RANDOM_LIBS) \
        $(BOOST_FILESYSTEM_LIBS) \
        $(BOOST_SYSTEM_LIBS)


FORCE:
$(srcdir)/.git-version: FORCE
        @if (test -d $(top_srcdir)/.git && cd $(srcdir) \
             && { git describe --dirty --always || git describe; } ) > .git-version-t 2>/dev/null \
          && ! diff .git-version-t $(srcdir)/.git-version >/dev/null 2>&1; then \
          mv -f .git-version-t $(srcdir)/.git-version; \
        else \
          rm -f .git-version-t; \
        fi

EXTRA_DIST += \
        $(srcdir)/.git-version \
        $(bondtable_DATA) \
        $(database_DATA) \
        $(molecule_DATA)

$(srcdir)/version.c: $(srcdir)/.git-version
        echo "const char *MOLECUILDERVERSION = \"$(PACKAGE_NAME) version "`cat $(srcdir)/.git-version`"\";" > $@


unity.cpp: ${MOLECUILDERSOURCE} ${MOLECUILDERHEADER}
        list='$(MOLECUILDERSOURCE)'; for file in $$list; do \
        echo "#include \"$(srcdir)/$$file\"" >> unity.cpp; \
        done; \
        subdirs='$(SUBDIRS)';for directory in $$subdirs; do\
                olddir=$$PWD;\
                cd $$directory && make unity.cpp;\
                cd $$olddir;\
                echo "#include \"$$directory/unity.cpp\"" >> unity.cpp;\
        done;\
        echo "#include \"$(srcdir)/builder.cpp\"" >> unity.cpp;
        echo "#include \"$(srcdir)/version.c\"" >> unity.cpp;

MOSTLYCLEANFILES += unity.cpp