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< |
INCLUDES = -I../libBASS -I@sprng_include@ |
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> |
#bookeeping |
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|
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< |
EXTRA_DIST = generic_list_functions.i90 |
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> |
INCLUDES = -I../libBASS -I@sprng_include@ -I@mpich_include@ -I@mpich_include@/mpi2c++ |
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|
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< |
pkglib_LIBRARIES = libmdCode.a |
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> |
.F90.o: |
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> |
$(F77) $(AM_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o $@ `test -f '$<' || echo '$(srcdir)/'`$< |
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< |
pkginclude_HEADERS = AbstractClasses.hpp Atom.hpp ForceFields.hpp \ |
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< |
Integrator.hpp ReadWrite.hpp SimInfo.hpp SimSetup.hpp SRI.hpp \ |
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< |
Thermo.hpp Molecule.hpp randomSPRNG.hpp |
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> |
.F90.obj: |
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> |
$(F77) $(AM_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o $@ `if test -f '$<'; then $(CYGPATH_W) '$<'; else $(CYGPATH_W) '$(srcdir)/$<'; fi` |
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– |
libmdCode_a_SOURCES = forceFactory.hpp fortranFncs.h Bend.cpp \ |
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– |
BendExtensions.cpp Bond.cpp BondExtensions.cpp DipoleTestFF.cpp \ |
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– |
DirectionalAtom.cpp DumpWriter.cpp InitializeFromFile.cpp LJ_FF.cpp \ |
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– |
SimInfo.cpp SimSetup.cpp StatWriter.cpp Symplectic.cpp Thermo.cpp \ |
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– |
Torsion.cpp TorsionExtensions.cpp TraPPE_ExFF.cpp TraPPEFF.cpp \ |
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– |
Verlet.cpp randomSPRNG.cpp atype_typedefs.F90 f_verlet_constrained.f \ |
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– |
generic_atype_recombination.F90 simulation_module.F90 lj_FF.F90 \ |
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– |
wrappers.F90 forceFactory.F90 |
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|
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< |
#ssd_FF.F90 TraPPE_ExFF_module.F90 |
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> |
#***************************************************************** |
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> |
# the single processor build |
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> |
# **************************************************************** |
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– |
generic_atype_recombination.o: generic_atype_recombination.F90 atype_typedefs.o |
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< |
lj_FF.o: lj_FF.F90 simulation_module.o generic_atype_recombination.o \ |
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< |
atype_typedefs.o |
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> |
pkglib_LIBRARIES = libmdCode.a libMPImdCode.a |
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|
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< |
wrappers.o: wrappers.F90 simulation_module.o |
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> |
pkginclude_HEADERS = AbstractClasses.hpp Atom.hpp ForceFields.hpp \ |
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> |
Integrator.hpp ReadWrite.hpp SimInfo.hpp SimSetup.hpp SRI.hpp \ |
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> |
Thermo.hpp Molecule.hpp randomSPRNG.hpp mpiForceField.h \ |
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> |
mpiSimulation.hpp mpiComponentPlan.h fSimulation.h fortranWrappers.hpp \ |
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> |
fortranWrapDefines.hpp |
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|
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< |
forceFactory.o: forceFactory.F90 lj_FF.o |
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> |
libmdCode_a_SOURCES = forceFactory.hpp fortranFncs.h Bend.cpp \ |
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> |
BendExtensions.cpp Bond.cpp BondExtensions.cpp DipoleTestFF.cpp \ |
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> |
DirectionalAtom.cpp DumpWriter.cpp InitializeFromFile.cpp LJ_FF.cpp \ |
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> |
SimInfo.cpp SimSetup.cpp StatWriter.cpp Symplectic.cpp Thermo.cpp \ |
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> |
Torsion.cpp TorsionExtensions.cpp TraPPE_ExFF.cpp TraPPEFF.cpp \ |
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> |
Verlet.cpp randomSPRNG.cpp fortranWrappers.cpp ForceFields.cpp \ |
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> |
atype_module.F90 f_verlet_constrained.f calc_dipole_dipole.F90 \ |
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> |
calc_reaction_field.F90 calc_LJ_FF.F90 calc_sticky_pair.F90 \ |
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> |
doForces.F90 vector_class.F90 simulation_module.F90 wrappers.F90 \ |
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> |
neighborLists.F90 |
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|
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< |
#ssd_FF.o: ssd_FF.F90 simulation_module.o generic_atype_recombination.o \ |
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< |
# atype_typedefs.o |
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> |
libmdCode_a_CXXFLAGS = -DFRC_PATH="$(pkgdatadir)" $(AM_CXXFLAGS) |
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+ |
#compiler and machine dependent fortran definitions |
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+ |
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+ |
EXTRA_libmdCode_a_SOURCES = Linux_ifc_machdep.F90 |
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+ |
libmdCode_a_LIBADD = @fortran_machine_defs@ |
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+ |
|
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+ |
|
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+ |
#fortran module dependencies |
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+ |
|
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+ |
atype_module.o: atype_module.F90 @fortran_machine_defs@ vector_class.o |
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+ |
|
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+ |
simulation_module.o: simulation_module.F90 @fortran_machine_defs@ atype_module.o neighborList.o |
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+ |
|
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+ |
wrappers.o: wrappers.F90 simulation_module.o @fortran_machine_defs@ do_Forces.o |
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+ |
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+ |
neighborLists.o: neighborLists.F90 @fortran_machine_defs@ |
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+ |
|
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+ |
calc_dipole_dipole.o: calc_dipole_dipole.F90 @fortran_machine_defs@ simulation_module.o vector_class.o |
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+ |
|
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+ |
calc_LJ_FF.o: calc_LJ_FF.F90 @fortran_machine_defs@ simulation_module.o vector_class.o atype_module.o |
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+ |
|
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+ |
calc_reaction_field.o: calc_reaction_field.F90 @fortran_machine_defs@ simulation_module.o vector_class.o atype_module.o |
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+ |
|
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+ |
calc_sticky_pair.o: calc_sticky_pair.F90 @fortran_machine_defs@ simulation_module.o |
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+ |
|
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+ |
do_Forces.o: do_Forces.F90 @fortran_machine_defs@ simulation_module.o atype_module.o neighborLists.o calc_LJ_FF.o \ |
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+ |
calc_sticky_pair.o calc_dipole_dipole.o calc_reaction_field.o |
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+ |
|
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+ |
#***************************************************************** |
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+ |
# MPI build |
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+ |
#**************************************************************** |
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+ |
|
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+ |
libMPImdCode_a_SOURCES = forceFactory.hpp fortranFncs.h Bend.cpp \ |
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+ |
BendExtensions.cpp Bond.cpp BondExtensions.cpp DipoleTestFF.cpp \ |
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+ |
DirectionalAtom.cpp DumpWriter.cpp InitializeFromFile.cpp LJ_FF.cpp \ |
| 73 |
+ |
SimInfo.cpp SimSetup.cpp StatWriter.cpp Symplectic.cpp Thermo.cpp \ |
| 74 |
+ |
Torsion.cpp TorsionExtensions.cpp TraPPE_ExFF.cpp TraPPEFF.cpp \ |
| 75 |
+ |
fortranWrappers.cpp ForceFields.cpp Verlet.cpp randomSPRNG.cpp \ |
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+ |
f_verlet_constrained.f mpiForceField.c mpiSimulation.cpp \ |
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+ |
mpiSimulation_module.F90 |
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+ |
|
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+ |
EXTRA_libMPImdCode_a_SOURCES = Linux_ifc_machdep.F90 |
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+ |
|
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+ |
libMPImdCode_a_LIBADD = @fortran_machine_defs@ \ |
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+ |
libMPImdCode_a-atype_module.$(OBJEXT) \ |
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libMPImdCode_a-simulation_module.$(OBJEXT) \ |
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libMPImdCode_a-neighborLists.$(OBJEXT) \ |
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+ |
libMPImdCode_a-calc_dipole_dipole.$(OBJEXT) \ |
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+ |
libMPImdCode_a-calc_LJ_FF.$(OBJEXT) \ |
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+ |
libMPImdCode_a-calc_reaction_field.$(OBJEXT) \ |
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+ |
libMPImdCode_a-calc_sticky_pair.$(OBJEXT) \ |
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+ |
libMPImdCode_a-do_Forces.$(OBJEXT) \ |
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+ |
libMPImdCode_a-wrappers.$(OBJEXT) \ |
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+ |
libMPImdCode_a-vector_class.$(OBJEXT) |
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+ |
|
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+ |
libMPImdCode_a_DEPENDENCIES = @fortran_machine_defs@ \ |
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+ |
libMPImdCode_a-atype_module.$(OBJEXT) \ |
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+ |
libMPImdCode_a-simulation_module.$(OBJEXT) \ |
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+ |
libMPImdCode_a-neighborLists.$(OBJEXT) \ |
| 97 |
+ |
libMPImdCode_a-calc_dipole_dipole.$(OBJEXT) \ |
| 98 |
+ |
libMPImdCode_a-calc_LJ_FF.$(OBJEXT) \ |
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+ |
libMPImdCode_a-calc_reaction_field.$(OBJEXT) \ |
| 100 |
+ |
libMPImdCode_a-calc_sticky_pair.$(OBJEXT) \ |
| 101 |
+ |
libMPImdCode_a-do_Forces.$(OBJEXT) \ |
| 102 |
+ |
libMPImdCode_a-wrappers.$(OBJEXT) \ |
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+ |
libMPImdCode_a-vector_class.$(OBJEXT) |
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+ |
|
| 105 |
+ |
libMPImdCode_a_CFLAGS = -DIS_MPI $(AM_CFLAGS) |
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+ |
libMPImdCode_a_CXXFLAGS = -DFRC_PATH="$(pkgdatadir)" -DIS_MPI $(AM_CXXFLAGS) |
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+ |
libMPImdCode_a_FFLAGS = -DIS_MPI $(AM_FFLAGS) |
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+ |
|
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+ |
#fortran module dependencies |
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+ |
|
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+ |
libMPImdCode_a-atype_module.o: atype_module.F90 @fortran_machine_defs@ libMPImdCode_a-vector_class.o |
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+ |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-atype_module.o `test -f 'atype_module.F90' || echo '$(srcdir)/'`atype_module.F90 |
| 113 |
+ |
|
| 114 |
+ |
libMPImdCode_a-simulation_module.o: simulation_module.F90 @fortran_machine_defs@ mpiSimulation_module.o \ |
| 115 |
+ |
libMPImdCode_a-atype_module.o libMPImdCode_a-neighborLists.o |
| 116 |
+ |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-simulation_module.o `test -f 'simulation_module.F90' || echo '$(srcdir)/'`simulation_module.F90 |
| 117 |
+ |
|
| 118 |
+ |
libMPImdCode_a-wrappers.o: wrappers.F90 libMPImdCode_a-simulation_module.o @fortran_machine_defs@ \ |
| 119 |
+ |
mpiSimulation_module.o libMPImdCode_a-do_Forces.o |
| 120 |
+ |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-wrappers.o `test -f 'wrappers.F90' || echo '$(srcdir)/'`wrappers.F90 |
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+ |
|
| 122 |
+ |
libMPImdCode_a-neighborLists.o: neighborLists.F90 mpiSimulation_module.o @fortran_machine_defs@ |
| 123 |
+ |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-neighborLists.o `test -f 'neighborLists.F90' || echo '$(srcdir)/'`neighborLists.F90 |
| 124 |
+ |
|
| 125 |
+ |
mpiSimulation_module.o: mpiSimulation_module.F90 @fortran_machine_defs@ |
| 126 |
+ |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o mpiSimulation_module.o `test -f 'mpiSimulation_module.F90' || echo '$(srcdir)/'`mpiSimulation_module.F90 |
| 127 |
+ |
|
| 128 |
+ |
libMPImdCode_a-calc_dipole_dipole.o: calc_dipole_dipole.F90 @fortran_machine_defs@ libMPImdCode_a-vector_class.o\ |
| 129 |
+ |
libMPImdCode_a-simulation_module.o mpiSimulation_module.o |
| 130 |
+ |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-calc_dipole_dipole.o `test -f 'calc_dipole_dipole.F90' || echo '$(srcdir)/'`calc_dipole_dipole.F90 |
| 131 |
+ |
|
| 132 |
+ |
libMPImdCode_a-calc_LJ_FF.o: calc_LJ_FF.F90 @fortran_machine_defs@ libMPImdCode_a-vector_class.o\ |
| 133 |
+ |
libMPImdCode_a-simulation_module.o mpiSimulation_module.o libMPImdCode_a-atype_module.o |
| 134 |
+ |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-calc_LJ_FF.o `test -f 'calc_LJ_FF.F90' || echo '$(srcdir)/'`calc_LJ_FF.F90 |
| 135 |
+ |
|
| 136 |
+ |
libMPImdCode_a-calc_reaction_field.o: calc_reaction_field.F90 @fortran_machine_defs@ libMPImdCode_a-vector_class.o\ |
| 137 |
+ |
libMPImdCode_a-simulation_module.o mpiSimulation_module.o libMPImdCode_a-atype_module.o |
| 138 |
+ |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-calc_reaction_field.o `test -f 'calc_reaction_field.F90' || echo '$(srcdir)/'`calc_reaction_field.F90 |
| 139 |
+ |
|
| 140 |
+ |
libMPImdCode_a-calc_sticky_pair.o: calc_sticky_pair.F90 @fortran_machine_defs@ \ |
| 141 |
+ |
libMPImdCode_a-simulation_module.o mpiSimulation_module.o |
| 142 |
+ |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-calc_sticky_pair.o `test -f 'calc_sticky_pair.F90' || echo '$(srcdir)/'`calc_sticky_pair.F90 |
| 143 |
+ |
|
| 144 |
+ |
libMPImdCode_a-do_Forces.o: do_Forces.F90 @fortran_machine_defs@ libMPImdCode_a-simulation_module.o mpiSimulation_module.o libMPImdCode_a-atype_module.o\ |
| 145 |
+ |
libMPImdCode_a-calc_sticky_pair.o libMPImdCode_a-calc_reaction_field.o libMPImdCode_a-calc_LJ_FF.o libMPImdCode_a-calc_dipole_dipole.o \ |
| 146 |
+ |
libMPImdCode_a-neighborLists.o |
| 147 |
+ |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-do_Forces.o `test -f 'do_Forces.F90' || echo '$(srcdir)/'`do_Forces.F90 |
| 148 |
+ |
|
| 149 |
+ |
libMPImdCode_a-vector_class.o: vector_class.F90 |
| 150 |
+ |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-vector_class.o `test -f 'vector_class.F90' || echo '$(srcdir)/'`vector_class.F90 |
