7 |
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|
8 |
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.F90.obj: |
9 |
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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` |
10 |
– |
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10 |
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11 |
+ |
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12 |
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#***************************************************************** |
13 |
|
# the single processor build |
14 |
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# **************************************************************** |
18 |
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|
19 |
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pkglib_LIBRARIES = libmdCode.a libMPImdCode.a |
20 |
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|
21 |
< |
pkginclude_HEADERS = AbstractClasses.hpp Atom.hpp ForceFields.hpp \ |
22 |
< |
Integrator.hpp ReadWrite.hpp SimInfo.hpp SimSetup.hpp SRI.hpp \ |
23 |
< |
Thermo.hpp Molecule.hpp randomSPRNG.hpp mpiForceField.h \ |
24 |
< |
mpiSimulation.hpp mpiComponentPlan.h |
21 |
> |
pkginclude_HEADERS = AbstractClasses.hpp Atom.hpp ForceFields.hpp \ |
22 |
> |
Integrator.hpp ReadWrite.hpp SimInfo.hpp SimSetup.hpp SRI.hpp \ |
23 |
> |
Thermo.hpp Molecule.hpp randomSPRNG.hpp mpiForceField.h \ |
24 |
> |
mpiSimulation.hpp mpiComponentPlan.h fSimulation.h fortranWrappers.hpp \ |
25 |
> |
fortranWrapDefines.hpp |
26 |
|
|
27 |
< |
libmdCode_a_SOURCES = forceFactory.hpp fortranFncs.h Bend.cpp \ |
28 |
< |
BendExtensions.cpp Bond.cpp BondExtensions.cpp DipoleTestFF.cpp \ |
29 |
< |
DirectionalAtom.cpp DumpWriter.cpp InitializeFromFile.cpp LJ_FF.cpp \ |
30 |
< |
SimInfo.cpp SimSetup.cpp StatWriter.cpp Symplectic.cpp Thermo.cpp \ |
31 |
< |
Torsion.cpp TorsionExtensions.cpp TraPPE_ExFF.cpp TraPPEFF.cpp \ |
32 |
< |
Verlet.cpp randomSPRNG.cpp atype_typedefs.F90 f_verlet_constrained.f \ |
33 |
< |
generic_atype_recombination.F90 simulation_module.F90 lj_FF.F90 \ |
34 |
< |
wrappers.F90 forceFactory.F90 |
27 |
> |
libmdCode_a_SOURCES = forceFactory.hpp fortranFncs.h Bend.cpp \ |
28 |
> |
BendExtensions.cpp Bond.cpp BondExtensions.cpp DipoleTestFF.cpp \ |
29 |
> |
DirectionalAtom.cpp DumpWriter.cpp InitializeFromFile.cpp LJ_FF.cpp \ |
30 |
> |
SimInfo.cpp SimSetup.cpp StatWriter.cpp Symplectic.cpp Thermo.cpp \ |
31 |
> |
Torsion.cpp TorsionExtensions.cpp TraPPE_ExFF.cpp TraPPEFF.cpp \ |
32 |
> |
Verlet.cpp randomSPRNG.cpp fortranWrappers.cpp ForceFields.cpp \ |
33 |
> |
atype_typedefs.F90 f_verlet_constrained.f \ |
34 |
> |
generic_atype_recombination.F90 simulation_module.F90 lj_FF.F90 \ |
35 |
> |
wrappers.F90 forceFactory.F90 neighborLists.F90 |
36 |
|
|
37 |
+ |
libmdCode_a_CXXFLAGS = -DFRC_PATH="$(pkgdatadir)" $(AM_CXXFLAGS) |
38 |
+ |
|
39 |
+ |
|
40 |
|
#compiler and machine dependent fortran definitions |
41 |
|
|
42 |
|
EXTRA_libmdCode_a_SOURCES = Linux_ifc_machdep.F90 |
43 |
|
libmdCode_a_LIBADD = @fortran_machine_defs@ |
44 |
|
|
45 |
|
|
46 |
< |
#ssd_FF.F90 TraPPE_ExFF_module.F90 |
46 |
> |
#fortran module dependencies |
47 |
|
|
48 |
|
atype_typedefs.o: atype_typedefs.F90 @fortran_machine_defs@ |
49 |
|
|
50 |
|
generic_atype_recombination.o: generic_atype_recombination.F90 atype_typedefs.o @fortran_machine_defs@ |
51 |
|
|
52 |
+ |
simulation_module.o: simulation_module.F90 @fortran_machine_defs@ |
53 |
+ |
|
54 |
|
lj_FF.o: lj_FF.F90 @fortran_machine_defs@ simulation_module.o generic_atype_recombination.o \ |
55 |
|
atype_typedefs.o |
56 |
|
|
57 |
+ |
#ssd_FF.o: ssd_FF.F89 @fortran_machine_defs@ simulation_module.o generic_atype_recombination.o \ |
58 |
+ |
# atype_typedefs.o |
59 |
+ |
|
60 |
|
wrappers.o: wrappers.F90 simulation_module.o @fortran_machine_defs@ |
61 |
|
|
62 |
+ |
neighborLists.o: neighborLists.F90 simulation_module.o @fortran_machine_defs@ |
63 |
+ |
|
64 |
|
forceFactory.o: forceFactory.F90 lj_FF.o @fortran_machine_defs@ |
65 |
|
|
54 |
– |
#ssd_FF.o: ssd_FF.F90 simulation_module.o generic_atype_recombination.o \ |
55 |
– |
# atype_typedefs.o |
66 |
|
|
67 |
|
|
68 |
|
#***************************************************************** |
69 |
|
# MPI build |
70 |
|
#**************************************************************** |
71 |
|
|
72 |
< |
libMPImdCode_a_SOURCES = forceFactory.hpp fortranFncs.h Bend.cpp \ |
73 |
< |
BendExtensions.cpp Bond.cpp BondExtensions.cpp DipoleTestFF.cpp \ |
74 |
< |
DirectionalAtom.cpp DumpWriter.cpp InitializeFromFile.cpp LJ_FF.cpp \ |
75 |
< |
SimInfo.cpp SimSetup.cpp StatWriter.cpp Symplectic.cpp Thermo.cpp \ |
76 |
< |
Torsion.cpp TorsionExtensions.cpp TraPPE_ExFF.cpp TraPPEFF.cpp \ |
77 |
< |
Verlet.cpp randomSPRNG.cpp atype_typedefs.F90 f_verlet_constrained.f \ |
78 |
< |
generic_atype_recombination.F90 simulation_module.F90 lj_FF.F90 \ |
69 |
< |
wrappers.F90 forceFactory.F90 mpiForceField.c mpiSimulation.cpp \ |
72 |
> |
libMPImdCode_a_SOURCES = forceFactory.hpp fortranFncs.h Bend.cpp \ |
73 |
> |
BendExtensions.cpp Bond.cpp BondExtensions.cpp DipoleTestFF.cpp \ |
74 |
> |
DirectionalAtom.cpp DumpWriter.cpp InitializeFromFile.cpp LJ_FF.cpp \ |
75 |
> |
SimInfo.cpp SimSetup.cpp StatWriter.cpp Symplectic.cpp Thermo.cpp \ |
76 |
> |
Torsion.cpp TorsionExtensions.cpp TraPPE_ExFF.cpp TraPPEFF.cpp \ |
77 |
> |
fortranWrappers.cpp ForceFields.cpp Verlet.cpp randomSPRNG.cpp \ |
78 |
> |
f_verlet_constrained.f mpiForceField.c mpiSimulation.cpp \ |
79 |
|
mpiSimulation_module.F90 |
80 |
|
|
81 |
|
EXTRA_libMPImdCode_a_SOURCES = Linux_ifc_machdep.F90 |
73 |
– |
libMPImdCode_a_LIBADD = @fortran_machine_defs@ |
82 |
|
|
83 |
+ |
libMPImdCode_a_LIBADD = @fortran_machine_defs@ \ |
84 |
+ |
libMPImdCode_a-atype_typedefs.$(OBJEXT) \ |
85 |
+ |
libMPImdCode_a-generic_atype_recombination.$(OBJEXT) \ |
86 |
+ |
libMPImdCode_a-simulation_module.$(OBJEXT) \ |
87 |
+ |
libMPImdCode_a-lj_FF.$(OBJEXT) libMPImdCode_a-wrappers.$(OBJEXT) \ |
88 |
+ |
libMPImdCode_a-forceFactory.$(OBJEXT) \ |
89 |
+ |
libMPImdCode_a-ssd_FF.$(OBJEXT) \ |
90 |
+ |
libMPImdCode_a-neighborLists.$(OBJEXT) |
91 |
+ |
|
92 |
+ |
libMPImdCode_a_DEPENDENCIES = @fortran_machine_defs@ \ |
93 |
+ |
libMPImdCode_a-atype_typedefs.$(OBJEXT) \ |
94 |
+ |
libMPImdCode_a-generic_atype_recombination.$(OBJEXT) \ |
95 |
+ |
libMPImdCode_a-simulation_module.$(OBJEXT) \ |
96 |
+ |
libMPImdCode_a-lj_FF.$(OBJEXT) libMPImdCode_a-wrappers.$(OBJEXT) \ |
97 |
+ |
libMPImdCode_a-forceFactory.$(OBJEXT) \ |
98 |
+ |
#libMPImdCode_a-ssd_FF.$(OBJEXT) \ |
99 |
+ |
libMPImdCode_a-neighborLists.$(OBJEXT) |
100 |
+ |
|
101 |
|
libMPImdCode_a_CFLAGS = -DIS_MPI $(AM_CFLAGS) |
102 |
< |
libMPImdCode_a_CXXFLAGS = -DIS_MPI $(AM_CXXFLAGS) |
102 |
> |
libMPImdCode_a_CXXFLAGS = -DFRC_PATH="$(pkgdatadir)" -DIS_MPI $(AM_CXXFLAGS) |
103 |
|
libMPImdCode_a_FFLAGS = -DIS_MPI $(AM_FFLAGS) |
104 |
|
|
105 |
+ |
#fortran module dependencies |
106 |
|
|
80 |
– |
|
81 |
– |
#ssd_FF.F90 TraPPE_ExFF_module.F90 |
82 |
– |
|
107 |
|
libMPImdCode_a-atype_typedefs.o: atype_typedefs.F90 @fortran_machine_defs@ |
108 |
< |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -c -o libMPImdCode_a-atype_typedefs.o `test -f 'atype_typedefs.F90' || echo '$(srcdir)/'`atype_typedefs.F90 |
109 |
< |
|
108 |
> |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-atype_typedefs.o `test -f 'atype_typedefs.F90' || echo '$(srcdir)/'`atype_typedefs.F90 |
109 |
> |
|
110 |
|
libMPImdCode_a-generic_atype_recombination.o: generic_atype_recombination.F90 \ |
111 |
|
libMPImdCode_a-atype_typedefs.o @fortran_machine_defs@ |
112 |
< |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -c -o libMPImdCode_a-generic_atype_recombination.o `test -f 'generic_atype_recombination.F90' || echo '$(srcdir)/'`generic_atype_recombination.F90 |
112 |
> |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-generic_atype_recombination.o `test -f 'generic_atype_recombination.F90' || echo '$(srcdir)/'`generic_atype_recombination.F90 |
113 |
|
|
114 |
+ |
libMPImdCode_a-simulation_module.o: simulation_module.F90 @fortran_machine_defs@ mpiSimulation_module.o |
115 |
+ |
$(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 |
116 |
+ |
|
117 |
|
libMPImdCode_a-lj_FF.o: lj_FF.F90 libMPImdCode_a-simulation_module.o \ |
118 |
|
libMPImdCode_a-generic_atype_recombination.o libMPImdCode_a-atype_typedefs.o @fortran_machine_defs@ |
119 |
< |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -c -o libMPImdCode_a-lj_FF.o `test -f 'lj_FF.F90' || echo '$(srcdir)/'`lj_FF.F90 |
119 |
> |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-lj_FF.o `test -f 'lj_FF.F90' || echo '$(srcdir)/'`lj_FF.F90 |
120 |
|
|
121 |
+ |
#libMPImdCode_a-ssd_FF.o: ssd_FF.F90 libMPImdCode_a-simulation_module.o \ |
122 |
+ |
# libMPImdCode_a-generic_atype_recombination.o libMPImdCode_a-atype_typedefs.o @fortran_machine_defs@ |
123 |
+ |
# $(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-ssd_FF.o `test -f 'ssd_FF.F90' || echo '$(srcdir)/'`ssd_FF.F90 |
124 |
+ |
|
125 |
|
libMPImdCode_a-wrappers.o: wrappers.F90 libMPImdCode_a-simulation_module.o @fortran_machine_defs@ |
126 |
< |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -c -o libMPImdCode_a-wrappers.o `test -f 'wrappers.F90' || echo '$(srcdir)/'`wrappers.F90 |
126 |
> |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-wrappers.o `test -f 'wrappers.F90' || echo '$(srcdir)/'`wrappers.F90 |
127 |
|
|
128 |
+ |
libMPImdCode_a-neighborLists.o: neighborLists.F90 mpiSimulation_module.o \ |
129 |
+ |
libMPImdCode_a-simulation_module.o @fortran_machine_defs@ |
130 |
+ |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-neighborLists.o `test -f 'neighborLists.F90' || echo '$(srcdir)/'`neighborLists.F90 |
131 |
+ |
|
132 |
|
libMPImdCode_a-forceFactory.o: forceFactory.F90 libMPImdCode_a-lj_FF.o @fortran_machine_defs@ |
133 |
< |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -c -o libMPImdCode_a-forceFactory.o `test -f 'forceFactory.F90' || echo '$(srcdir)/'`forceFactory.F90 |
133 |
> |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o libMPImdCode_a-forceFactory.o `test -f 'forceFactory.F90' || echo '$(srcdir)/'`forceFactory.F90 |
134 |
|
|
135 |
< |
libMPImdCode_a-mpiSimulation_module.o: mpiSimulation_module.F90 libMPImdCode_a-lj_FF.o @fortran_machine_defs@ |
136 |
< |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -c -o libMPImdCode_a-mpiSimulation_module.o `test -f 'mpiSimulation_module.F90' || echo '$(srcdir)/'`mpiSimulation_module.F90 |
135 |
> |
mpiSimulation_module.o: mpiSimulation_module.F90 @fortran_machine_defs@ |
136 |
> |
$(F77) $(libMPImdCode_a_FFLAGS) $(FFLAGS) -I@mpich_include@/f90choice -c -o mpiSimulation_module.o `test -f 'mpiSimulation_module.F90' || echo '$(srcdir)/'`mpiSimulation_module.F90 |
137 |
|
|
103 |
– |
#ssd_FF.o: ssd_FF.F90 simulation_module.o generic_atype_recombination.o \ |
104 |
– |
# atype_typedefs.o |
105 |
– |
|
138 |
|
|
107 |
– |
|