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root/group/trunk/OOPSE/libmdtools/Makefile
Revision: 574
Committed: Tue Jul 8 20:56:10 2003 UTC (20 years, 11 months ago) by gezelter
File size: 8419 byte(s)
Log Message:
NPTi

File Contents

# User Rev Content
1 mmeineke 377 #####################################################
2     # Makefile for libmdtools (bundled with OOPSE) #
3     #####################################################
4     # You should not change anything here. #
5     #####################################################
6    
7     TOP=..
8    
9     include $(TOP)/Make.conf
10    
11     .SUFFIXES : .c .cpp .F90 .hpp .h $(O)
12    
13     # First do compile-time flags:
14    
15 gezelter 385 DECLARES= -DFRC_PATH="$(FORCE_PARAM_DIR)"
16 mmeineke 377 MPI_DECLARES= -DIS_MPI
17    
18     # include paths starting with "." are all relative to the SUBDIRS!!!
19    
20     INCLUDES= -I.. -I../../libBASS -I$(SPRNG_INC)
21 mmeineke 447 MPI_INCLUDES= -I$(MPICH_INC) -I$(MPI_F90_MODS)
22 mmeineke 377
23     CFLAGS=$(CFLAGS_C) $(INCLUDES) $(DECLARES) $(MPI_INCLUDES)
24     CXXFLAGS=$(CXXFLAGS_C) $(INCLUDES) $(DECLARES)
25     FFLAGS=$(FFLAGS_C) $(DECLARES)
26     DEPFLAGS=$(CFLAGS_C) -I. -I../libBASS -I$(SPRNG_INC) $(MPI_INCLUDES)
27    
28     MPI_CFLAGS=$(CFLAGS) $(MPI_INCLUDES) $(MPI_DECLARES)
29     MPI_CXXFLAGS=$(CXXFLAGS) $(MPI_INCLUDES) $(MPI_DECLARES)
30     MPI_FFLAGS=$(FFLAGS) $(MPI_INCLUDES) $(MPI_DECLARES)
31    
32 mmeineke 561 SRC_DIR := $(PWD)
33    
34 mmeineke 377 # Then do the compile rules:
35    
36     obj/%.o: %.F90
37 mmeineke 561 cd obj; $(FC) $(FFLAGS) -c $(SRC_DIR)/$<
38 mmeineke 377
39     MPIobj/%.o: %.F90
40 mmeineke 561 cd MPIobj; $(FC) $(MPI_FFLAGS) -c $(SRC_DIR)/$<
41 mmeineke 377
42     obj/%.o: %.cpp
43 mmeineke 561 cd obj; $(CXX) $(CXXFLAGS) -c $(SRC_DIR)/$<
44 mmeineke 377
45     MPIobj/%.o: %.cpp
46 mmeineke 561 cd MPIobj; $(CXX) $(MPI_CXXFLAGS) -c $(SRC_DIR)/$<
47 mmeineke 377
48     obj/%.o: %.c
49 mmeineke 561 cd obj; $(CC) $(CFLAGS) -c $(SRC_DIR)/$<
50 mmeineke 377
51     MPIobj/%.o: %.c
52 mmeineke 561 cd MPIobj; $(CC) $(MPI_CFLAGS) -c $(SRC_DIR)/$<
53 mmeineke 377
54     # Then list what we have to compile
55    
56     C_FILES = $(DIR)/mpiForceField.c
57    
58     CXX_FILES = \
59 gezelter 411 $(DIR)/Atom.cpp \
60 mmeineke 377 $(DIR)/Bend.cpp \
61     $(DIR)/BendExtensions.cpp \
62     $(DIR)/Bond.cpp \
63     $(DIR)/BondExtensions.cpp \
64     $(DIR)/DirectionalAtom.cpp \
65     $(DIR)/DumpWriter.cpp \
66 gezelter 411 $(DIR)/Exclude.cpp \
67 mmeineke 377 $(DIR)/InitializeFromFile.cpp \
68 mmeineke 559 $(DIR)/LJFF.cpp \
69 mmeineke 377 $(DIR)/SimInfo.cpp \
70     $(DIR)/SimSetup.cpp \
71     $(DIR)/StatWriter.cpp \
72 mmeineke 559 $(DIR)/Integrator.cpp \
73 mmeineke 377 $(DIR)/Thermo.cpp \
74     $(DIR)/GhostBend.cpp \
75     $(DIR)/Torsion.cpp \
76     $(DIR)/TorsionExtensions.cpp \
77 mmeineke 559 $(DIR)/DUFF.cpp \
78 mmeineke 377 $(DIR)/randomSPRNG.cpp \
79     $(DIR)/fortranWrappers.cpp \
80     $(DIR)/ForceFields.cpp \
81 mmeineke 424 $(DIR)/mpiSimulation.cpp \
82 mmeineke 561 $(DIR)/Molecule.cpp \
83 gezelter 574 $(DIR)/NVT.cpp \
84     $(DIR)/NPTi.cpp
85 mmeineke 377
86    
87     F90_FILES= \
88     $(DIR)/Linux_ifc_machdep.F90 \
89     $(DIR)/atype_module.F90 \
90     $(DIR)/f_verlet_constrained.F90 \
91     $(DIR)/calc_dipole_dipole.F90 \
92     $(DIR)/calc_reaction_field.F90 \
93     $(DIR)/calc_LJ_FF.F90 \
94     $(DIR)/calc_sticky_pair.F90 \
95     $(DIR)/do_Forces.F90 \
96     $(DIR)/vector_class.F90 \
97     $(DIR)/simulation_module.F90 \
98     $(DIR)/wrappers.F90 \
99     $(DIR)/neighborLists.F90 \
100     $(DIR)/calc_gb.F90 \
101     $(DIR)/force_globals.F90 \
102     $(DIR)/mpiSimulation_module.F90
103    
104     DIR:=.
105     C_SRCS := $(C_FILES)
106     CXX_SRCS := $(CXX_FILES)
107     F90_SRCS := $(F90_FILES)
108 gezelter 385 SRCS := $(C_SRCS) $(CXX_SRCS) $(F90_SRCS)
109 mmeineke 377
110     DIR:=obj
111     C_OBJS := $(C_FILES:.c=.o)
112     CXX_OBJS := $(CXX_FILES:.cpp=.o)
113     F90_OBJS := $(F90_FILES:.F90=.o)
114     OBJS := $(C_OBJS) $(CXX_OBJS) $(F90_OBJS)
115    
116     DIR:=MPIobj
117     C_MPIOBJS := $(C_FILES:.c=.o)
118     CXX_MPIOBJS := $(CXX_FILES:.cpp=.o)
119     F90_MPIOBJS := $(F90_FILES:.F90=.o)
120     MPIOBJS := $(C_MPIOBJS) $(CXX_MPIOBJS) $(F90_MPIOBJS)
121    
122     LIBSUBDIRS = \
123     obj \
124     MPIobj
125    
126     # Possible make targets:
127    
128 mmeineke 379 all: Make.dep libmdtools.a libmdtools_MPI.a
129 mmeineke 377
130     libmdtools.a: $(OBJS)
131     $(RM) $@
132     $(AR) cr $@ $(OBJS)
133     $(RANLIB) $@
134    
135     libmdtools_MPI.a: $(MPIOBJS)
136     $(RM) $@
137     $(AR) cr $@ $(MPIOBJS)
138     $(RANLIB) $@
139    
140     .PHONY : clean
141    
142     clean : dummy
143     for i in $(LIBSUBDIRS); do \
144     (cd $$i; $(RM) *.o *.mod) || exit 1; \
145     done
146     $(RM) libmdtools.a libmdtools_MPI.a *.o *.mod *~ Make.temp Make.ftemp
147    
148     distclean : dummy
149     for i in $(LIBSUBDIRS); do \
150     (cd $$i; $(RM) *.o *.mod) || exit 1; \
151     done
152 gezelter 385 $(RM) libmdtools.a libmdtools_MPI.a *.o *.mod *~ Make.temp Make.ftemp Make.dep
153 mmeineke 377
154 gezelter 385 depend : Make.dep
155 mmeineke 379
156 gezelter 385 Make.dep : $(SRCS)
157 mmeineke 377 echo "Only C dependencies are made automagically!"
158     echo "# DO NOT DELETE THIS LINE - used by make depend" > Make.dep
159     $(CC) $(DEPFLAGS) -MM $(C_SRCS) $(CXX_SRCS) \
160     | sed 's/\.o:/\$$(O)\ :/g' > Make.temp
161 mmeineke 573 cat Make.temp | sed 's/^[a-zA-Z0-9]/obj\/&/g' >> Make.dep
162     cat Make.temp | sed 's/^[a-zA-Z0-9]/MPIobj\/&/g' >> Make.dep
163 gezelter 385 # ../scripts/sfmakedepend -I $(MPI_F90_MODS) -d obj -f ./Make.ftemp -h *.F90
164     # ../scripts/sfmakedepend -I $(MPI_F90_MODS) -d MPIobj -f ./Make.ftemp -h *.F90
165 mmeineke 377 # cat Make.ftemp | sed 's/\.o:/\$$(O)\ :/g' >> Make.dep
166     $(RM) Make.ftemp Make.temp
167    
168     install : dummy
169    
170     links : dummy
171    
172     tests : dummy
173    
174     dummy :
175    
176     include Make.dep
177    
178 gezelter 386 obj/$(F_MACH_DEFS): ./Linux_ifc_machdep.F90
179 mmeineke 377
180 gezelter 386 obj/vector_class$(O): ./vector_class.F90
181 mmeineke 377
182 gezelter 386 obj/force_globals$(O): ./force_globals.F90 \
183 mmeineke 377 obj/$(F_MACH_DEFS)
184    
185 gezelter 386 obj/neighborLists$(O): ./neighborLists.F90 \
186 mmeineke 377 obj/$(F_MACH_DEFS)
187    
188 gezelter 386 obj/calc_sticky_pair$(O): ./calc_sticky_pair.F90 \
189 mmeineke 377 obj/$(F_MACH_DEFS) \
190 chuckv 460 obj/simulation_module$(O) \
191 mmeineke 377 obj/force_globals$(O)
192    
193 gezelter 386 obj/calc_gb$(O): ./calc_gb.F90 \
194 mmeineke 377 obj/$(F_MACH_DEFS) \
195 chuckv 460 obj/simulation_module$(O) \
196 mmeineke 377 obj/force_globals$(O)
197    
198 gezelter 386 obj/atype_module$(O): ./atype_module.F90 \
199 mmeineke 377 obj/$(F_MACH_DEFS) \
200 gezelter 462 obj/vector_class$(O)
201 mmeineke 377
202 gezelter 386 obj/simulation_module$(O): ./simulation_module.F90 \
203 mmeineke 377 obj/$(F_MACH_DEFS) \
204 chuckv 460 obj/vector_class$(O) \
205     obj/force_globals$(O) \
206 mmeineke 377 obj/atype_module$(O) \
207     obj/neighborLists$(O)
208    
209 gezelter 386 obj/calc_LJ_FF$(O): ./calc_LJ_FF.F90 \
210 mmeineke 377 obj/$(F_MACH_DEFS) \
211     obj/atype_module$(O) \
212 chuckv 460 obj/simulation_module$(O) \
213 mmeineke 377 obj/vector_class$(O) \
214     obj/force_globals$(O)
215    
216 gezelter 386 obj/calc_reaction_field$(O): ./calc_reaction_field.F90 \
217 mmeineke 377 obj/$(F_MACH_DEFS) \
218     obj/vector_class$(O) \
219 gezelter 462 obj/atype_module$(O) \
220 chuckv 460 obj/simulation_module$(O) \
221 mmeineke 377 obj/force_globals$(O)
222    
223 gezelter 386 obj/calc_dipole_dipole$(O): ./calc_dipole_dipole.F90 \
224 mmeineke 377 obj/$(F_MACH_DEFS) \
225     obj/atype_module$(O) \
226 chuckv 460 obj/simulation_module$(O) \
227 mmeineke 377 obj/force_globals$(O) \
228     obj/vector_class$(O)
229    
230 gezelter 386 obj/do_Forces$(O): ./do_Forces.F90 \
231 mmeineke 377 obj/$(F_MACH_DEFS) \
232 gezelter 462 obj/atype_module$(O) \
233 mmeineke 377 obj/simulation_module$(O) \
234     obj/neighborLists$(O) \
235     obj/calc_LJ_FF$(O) \
236     obj/calc_sticky_pair$(O) \
237     obj/calc_dipole_dipole$(O) \
238     obj/calc_reaction_field$(O) \
239     obj/calc_gb$(O) \
240     obj/force_globals$(O)
241    
242 gezelter 386 obj/wrappers$(O): ./wrappers.F90 \
243 mmeineke 377 obj/$(F_MACH_DEFS) \
244 gezelter 462 obj/atype_module$(O) \
245 mmeineke 377 obj/simulation_module$(O) \
246 gezelter 462 obj/calc_sticky_pair$(O) \
247     obj/calc_gb$(O) \
248 mmeineke 377 obj/do_Forces$(O)
249    
250     #MPI dependencies:
251    
252 gezelter 386 MPIobj/$(F_MACH_DEFS): ./Linux_ifc_machdep.F90
253 mmeineke 377
254 gezelter 386 MPIobj/vector_class$(O): ./vector_class.F90
255 mmeineke 377
256 gezelter 386 MPIobj/mpiSimulation_module$(O): ./mpiSimulation_module.F90
257 mmeineke 377
258 gezelter 386 MPIobj/force_globals$(O): ./force_globals.F90 \
259 mmeineke 377 MPIobj/mpiSimulation_module$(O) \
260     MPIobj/$(F_MACH_DEFS)
261    
262 gezelter 386 MPIobj/neighborLists$(O): ./neighborLists.F90 \
263 mmeineke 377 MPIobj/$(F_MACH_DEFS) \
264     MPIobj/mpiSimulation_module$(O)
265    
266 gezelter 386 MPIobj/calc_sticky_pair$(O): ./calc_sticky_pair.F90 \
267 mmeineke 377 MPIobj/$(F_MACH_DEFS) \
268 chuckv 460 MPIobj/simulation_module$(O) \
269 mmeineke 377 MPIobj/mpiSimulation_module$(O) \
270     MPIobj/force_globals$(O)
271    
272 gezelter 386 MPIobj/calc_gb$(O): ./calc_gb.F90 \
273 mmeineke 377 MPIobj/$(F_MACH_DEFS) \
274 chuckv 460 MPIobj/simulation_module$(O) \
275 mmeineke 377 MPIobj/mpiSimulation_module$(O) \
276     MPIobj/force_globals$(O)
277    
278 gezelter 386 MPIobj/atype_module$(O): ./atype_module.F90 \
279 mmeineke 377 MPIobj/$(F_MACH_DEFS) \
280 gezelter 462 MPIobj/vector_class$(O)
281 mmeineke 377
282 gezelter 386 MPIobj/simulation_module$(O): ./simulation_module.F90 \
283 mmeineke 377 MPIobj/$(F_MACH_DEFS) \
284 gezelter 462 MPIobj/atype_module$(O) \
285 chuckv 460 MPIobj/vector_class$(O) \
286     MPIobj/force_globals$(O) \
287 mmeineke 377 MPIobj/mpiSimulation_module$(O) \
288     MPIobj/atype_module$(O) \
289     MPIobj/neighborLists$(O)
290    
291 gezelter 386 MPIobj/calc_LJ_FF$(O): ./calc_LJ_FF.F90 \
292 mmeineke 377 MPIobj/$(F_MACH_DEFS) \
293 gezelter 462 MPIobj/atype_module$(O) \
294 chuckv 460 MPIobj/simulation_module$(O) \
295 mmeineke 377 MPIobj/mpiSimulation_module$(O) \
296     MPIobj/atype_module$(O) \
297     MPIobj/vector_class$(O) \
298     MPIobj/force_globals$(O)
299    
300 gezelter 386 MPIobj/calc_reaction_field$(O): ./calc_reaction_field.F90 \
301 mmeineke 377 MPIobj/$(F_MACH_DEFS) \
302 gezelter 462 MPIobj/atype_module$(O) \
303 chuckv 460 MPIobj/simulation_module$(O) \
304 mmeineke 377 MPIobj/mpiSimulation_module$(O) \
305     MPIobj/vector_class$(O) \
306     MPIobj/atype_module$(O) \
307     MPIobj/force_globals$(O)
308    
309 gezelter 386 MPIobj/calc_dipole_dipole$(O): ./calc_dipole_dipole.F90 \
310 mmeineke 377 MPIobj/$(F_MACH_DEFS) \
311 gezelter 462 MPIobj/atype_module$(O) \
312 chuckv 460 MPIobj/simulation_module$(O) \
313 mmeineke 377 MPIobj/mpiSimulation_module$(O) \
314     MPIobj/force_globals$(O) \
315     MPIobj/vector_class$(O)
316    
317 gezelter 386 MPIobj/do_Forces$(O): ./do_Forces.F90 \
318 mmeineke 377 MPIobj/$(F_MACH_DEFS) \
319     MPIobj/mpiSimulation_module$(O) \
320 gezelter 462 MPIobj/atype_module$(O) \
321 mmeineke 377 MPIobj/simulation_module$(O) \
322     MPIobj/neighborLists$(O) \
323     MPIobj/calc_LJ_FF$(O) \
324     MPIobj/calc_sticky_pair$(O) \
325     MPIobj/calc_dipole_dipole$(O) \
326     MPIobj/calc_reaction_field$(O) \
327     MPIobj/calc_gb$(O) \
328     MPIobj/force_globals$(O)
329    
330 gezelter 386 MPIobj/wrappers$(O): ./wrappers.F90 \
331 mmeineke 377 MPIobj/$(F_MACH_DEFS) \
332     MPIobj/mpiSimulation_module$(O) \
333 gezelter 462 MPIobj/atype_module$(O) \
334 mmeineke 377 MPIobj/simulation_module$(O) \
335 gezelter 462 MPIobj/calc_sticky_pair$(O) \
336     MPIobj/calc_gb$(O) \
337 mmeineke 377 MPIobj/do_Forces$(O)