1 |
gezelter |
747 |
##################################################### |
2 |
|
|
# Makefile for OOPSE # |
3 |
|
|
##################################################### |
4 |
|
|
# You should not change anything here. # |
5 |
|
|
##################################################### |
6 |
|
|
|
7 |
|
|
# No make rules by default |
8 |
|
|
.SUFFIXES : .c $(O) |
9 |
|
|
|
10 |
|
|
# Extension of object files |
11 |
|
|
O=@OBJEXT@ |
12 |
|
|
|
13 |
|
|
# Extension of executables |
14 |
|
|
EXE=@EXEEXT@ |
15 |
|
|
|
16 |
|
|
# Bourn shell |
17 |
|
|
SHELL=/bin/sh |
18 |
|
|
|
19 |
|
|
# Path prefix for installation links |
20 |
|
|
PREFIX=@prefix@ |
21 |
|
|
|
22 |
|
|
# List of subdirectories |
23 |
|
|
SUBDIRS=@SUBDIRS@ |
24 |
|
|
|
25 |
|
|
# Location of the oopse home |
26 |
|
|
OOPSE_HOME=@OOPSE_HOME@ |
27 |
|
|
|
28 |
|
|
FORCE_PARAM_DIR=@OOPSE_HOME@/share/forceFields/ |
29 |
|
|
SAMPLE_SIM_DIR=@OOPSE_HOME@/share/samples/ |
30 |
|
|
|
31 |
|
|
# SPRNG library path |
32 |
|
|
SPRNG_LIBDIR=@SPRNG_LIBDIR@ |
33 |
|
|
|
34 |
|
|
# SPRNG library |
35 |
|
|
SPRNG_LIB=@SPRNG_LIB@ |
36 |
|
|
|
37 |
|
|
# SPRNG include path |
38 |
|
|
SPRNG_INC=@SPRNG_INC@ |
39 |
|
|
|
40 |
|
|
# MPICH library path |
41 |
|
|
MPI_LIBDIR=@MPI_LIBDIR@ |
42 |
|
|
|
43 |
|
|
# MPICH library |
44 |
|
|
MPI_LIB=@MPI_LIB@ |
45 |
|
|
|
46 |
|
|
# MPICH include path |
47 |
|
|
MPI_INC=@MPI_INC@ |
48 |
|
|
|
49 |
|
|
# Location of yacc (or its substitution) |
50 |
|
|
YACC=@YACC@ |
51 |
|
|
|
52 |
|
|
#location of lex |
53 |
|
|
LEX=@LEX@ |
54 |
|
|
|
55 |
|
|
# C compiler |
56 |
|
|
CC=@CC@ |
57 |
|
|
|
58 |
|
|
# C++ compiler |
59 |
|
|
|
60 |
|
|
CXX=@CXX@ |
61 |
|
|
|
62 |
|
|
# F90 compiler |
63 |
|
|
F90=@F90@ |
64 |
|
|
|
65 |
gezelter |
785 |
# F90 libraries (for linking with C) |
66 |
|
|
F90LIBS=@F90LIBS@ |
67 |
|
|
|
68 |
gezelter |
747 |
# ar |
69 |
|
|
AR=@AR@ |
70 |
|
|
|
71 |
|
|
# ranlib |
72 |
|
|
RANLIB=@RANLIB@ |
73 |
|
|
|
74 |
|
|
# rm |
75 |
|
|
RM=rm -f |
76 |
|
|
|
77 |
|
|
# soft link |
78 |
|
|
LN_S=@LN_S@ |
79 |
|
|
|
80 |
|
|
# BSD install |
81 |
|
|
INSTALL=@INSTALL@ |
82 |
|
|
INSTALL_PROGRAM=@INSTALL_PROGRAM@ |
83 |
|
|
INSTALL_DATA=@INSTALL_DATA@ |
84 |
|
|
MKINSTALLDIRS=@MKINSTALLDIRS@ |
85 |
|
|
|
86 |
|
|
# CPP flags |
87 |
|
|
CPPFLAGS=@CPPFLAGS@ |
88 |
|
|
|
89 |
|
|
# C flags |
90 |
|
|
CFLAGS_C=@CFLAGS@ |
91 |
|
|
|
92 |
|
|
# C++ flags |
93 |
|
|
CXXFLAGS_C=@CXXFLAGS@ |
94 |
|
|
|
95 |
gezelter |
840 |
# C++ template flags |
96 |
|
|
OOPSE_TEMPLATE_FLAGS=@OOPSE_TEMPLATE_FLAGS@ |
97 |
|
|
|
98 |
|
|
# C++ namespace flag |
99 |
|
|
EXTRA_CC_FLAG=@EXTRA_CC_FLAG@ |
100 |
|
|
|
101 |
gezelter |
747 |
# Preprocessor flag for fortran |
102 |
|
|
PREPFLAG=@PREPFLAG@ |
103 |
|
|
|
104 |
|
|
# Preprocessor define flag for fortran |
105 |
|
|
PREPDEFFLAG=@PREPDEFFLAG@ |
106 |
|
|
|
107 |
|
|
# Fortran flags |
108 |
|
|
FFLAGS_C=@FFLAGS@ |
109 |
|
|
|
110 |
gezelter |
785 |
# Fortran90 flags |
111 |
|
|
F90FLAGS_C=@F90FLAGS@ |
112 |
|
|
|
113 |
gezelter |
747 |
# LDFLAGS |
114 |
|
|
LDFLAGS=@LDFLAGS@ |
115 |
|
|
|
116 |
|
|
TOP=.. |
117 |
|
|
|
118 |
|
|
# First do compile-time flags: |
119 |
|
|
|
120 |
|
|
MPI_DECLARES= -DIS_MPI |
121 |
|
|
|
122 |
|
|
# include paths starting with "." are all relative to the SUBDIRS!!! |
123 |
|
|
|
124 |
|
|
INCLUDES= -I.. -I../../libBASS -I../../libmdtools |
125 |
|
|
MPI_INCLUDES= -I$(MPI_INC) |
126 |
gezelter |
840 |
CXXFLAGS=$(CXXFLAGS_C) $(OOPSE_TEMPLATE_FLAGS) $(EXTRA_CC_FLAG) $(INCLUDES) $(DECLARES) |
127 |
gezelter |
747 |
DEPFLAGS=$(CFLAGS_C) -I. $(SPRNG_INC) $(MPI_INCLUDES) -I../libBASS -I../libmdtools |
128 |
|
|
MPI_CXXFLAGS=$(CXXFLAGS) $(MPI_INCLUDES) $(MPI_DECLARES) |
129 |
|
|
|
130 |
|
|
OOPSE=oopse$(EXE) |
131 |
|
|
OOPSE_MPI=oopse_MPI$(EXE) |
132 |
|
|
|
133 |
|
|
BASS_LIB=$(TOP)/libBASS/libBASS.a |
134 |
|
|
BASS_MPI_LIB=$(TOP)/libBASS/libBASS_MPI.a |
135 |
|
|
MD_LIB=$(TOP)/libmdtools/libmdtools.a |
136 |
|
|
MD_MPI_LIB=$(TOP)/libmdtools/libmdtools_MPI.a |
137 |
gezelter |
785 |
LIBS=$(MD_LIB) $(BASS_LIB) |
138 |
|
|
MPI_LIBS=$(MD_MPI_LIB) $(BASS_MPI_LIB) |
139 |
gezelter |
747 |
|
140 |
gezelter |
834 |
OOPSE_LDFLAGS= $(LIBS) $(F90LIBS) -L$(SPRNG_LIBDIR) $(SPRNG_LIB) |
141 |
gezelter |
747 |
|
142 |
gezelter |
942 |
OOPSE_MPI_LDFLAGS= $(MPI_LIBS) $(F90LIBS) -L$(MPI_LIBDIR) $(MPI_LIB) -L$(SPRNG_LIBDIR) $(SPRNG_LIB) |
143 |
gezelter |
747 |
|
144 |
gezelter |
839 |
|
145 |
gezelter |
747 |
PREFS=-DOOPSE_HOME=\"$(OOPSE_HOME)\" |
146 |
|
|
|
147 |
|
|
obj/%.o: %.cpp |
148 |
|
|
cd obj; $(CXX) $(CXXFLAGS) -c ../$< |
149 |
|
|
|
150 |
|
|
MPIobj/%.o: %.cpp |
151 |
|
|
cd MPIobj; $(CXX) $(MPI_CXXFLAGS) -c ../$< |
152 |
|
|
|
153 |
|
|
CXX_FILES = \ |
154 |
|
|
$(DIR)/oopse.cpp \ |
155 |
|
|
$(DIR)/oose.cpp |
156 |
|
|
|
157 |
|
|
DIR:=. |
158 |
|
|
CXX_SRCS := $(CXX_FILES) |
159 |
|
|
|
160 |
|
|
DIR:=obj |
161 |
|
|
CXX_OBJS := $(CXX_FILES:.cpp=.o) |
162 |
|
|
OBJS := $(CXX_OBJS) |
163 |
|
|
|
164 |
|
|
DIR:=MPIobj |
165 |
|
|
CXX_MPIOBJS := $(CXX_FILES:.cpp=.o) |
166 |
|
|
MPIOBJS := $(CXX_MPIOBJS) |
167 |
|
|
|
168 |
|
|
LIBSUBDIRS = \ |
169 |
|
|
obj \ |
170 |
|
|
MPIobj |
171 |
|
|
|
172 |
|
|
all : $(OOPSE) $(OOPSE_MPI) |
173 |
|
|
|
174 |
|
|
depend: Make.dep |
175 |
|
|
|
176 |
|
|
oopse$(EXE) : $(OBJS) $(BASS_LIB) $(MD_LIB) |
177 |
|
|
$(CXX) $(CFLAGS) $(OBJS) -g -o $@ $(OOPSE_LDFLAGS) |
178 |
|
|
|
179 |
|
|
oopse_MPI$(EXE) : $(MPIOBJS) $(BASS_MPI_LIB) $(MD_MPI_LIB) |
180 |
|
|
$(CXX) $(CFLAGS) $(MPIOBJS) -g -o $@ $(OOPSE_MPI_LDFLAGS) |
181 |
|
|
|
182 |
|
|
install : $(OOPSE) $(OOPSE_MPI) |
183 |
|
|
$(MKINSTALLDIRS) $(OOPSE_HOME)/bin |
184 |
|
|
$(INSTALL_PROGRAM) -s $(OOPSE) $(OOPSE_HOME)/bin/$(OOPSE) |
185 |
|
|
$(INSTALL_PROGRAM) -s $(OOPSE_MPI) $(OOPSE_HOME)/bin/$(OOPSE_MPI) |
186 |
|
|
|
187 |
|
|
tests : dummy |
188 |
|
|
|
189 |
|
|
$(OOPSE_HOME)/bin/$(OOPSE) : $(OOPSE) |
190 |
|
|
$(MAKE) install |
191 |
|
|
|
192 |
|
|
$(OOPSE_HOME)/bin/$(OOPSE_MPI) : $(OOPSE_MPI) |
193 |
|
|
$(MAKE) install |
194 |
|
|
|
195 |
|
|
links : $(OOPSE_HOME)/bin/$(OOPSE) $(OOPSE_HOME)/bin/$(OOPSE_MPI) |
196 |
|
|
$(MKINSTALLDIRS) $(PREFIX)/bin |
197 |
|
|
cd $(PREFIX)/bin; $(LN_S) -f $(OOPSE_HOME)/bin/$(OOPSE) $(OOPSE) |
198 |
|
|
cd $(PREFIX)/bin; $(LN_S) -f $(OOPSE_HOME)/bin/$(OOPSE_MPI) $(OOPSE_MPI) |
199 |
|
|
|
200 |
|
|
clean : dummy |
201 |
|
|
for i in $(LIBSUBDIRS); do \ |
202 |
|
|
(cd $$i; $(RM) *.o) || exit 1; \ |
203 |
|
|
done |
204 |
|
|
$(RM) $(OOPSE) $(OOPSE_MPI) *.o *~ Make.temp |
205 |
|
|
|
206 |
|
|
distclean : dummy |
207 |
|
|
for i in $(LIBSUBDIRS); do \ |
208 |
|
|
(cd $$i; $(RM) *.o) || exit 1; \ |
209 |
|
|
done |
210 |
gezelter |
785 |
$(RM) $(OOPSE) $(OOPSE_MPI) *.o *~ Make.temp |
211 |
gezelter |
747 |
|
212 |
|
|
devclean : distclean |
213 |
|
|
|
214 |
|
|
Make.dep : |
215 |
|
|
echo "# DO NOT DELETE THIS LINE - used by make depend" > Make.dep |
216 |
|
|
$(CXX) $(DEPFLAGS) -MM $(CXX_SRCS) \ |
217 |
|
|
| sed 's/\.o:/\$$(O)\ :/g' > Make.temp |
218 |
|
|
cat Make.temp | sed 's/^[a-zA-Z0-9]/obj\/&/g' >> Make.dep |
219 |
|
|
cat Make.temp | sed 's/^[a-zA-Z0-9]/MPIobj\/&/g' >> Make.dep |
220 |
|
|
$(RM) Make.temp |
221 |
|
|
|
222 |
|
|
tags : $(CXX_SRCS) |
223 |
|
|
ctags $(CXX_SRCS) |
224 |
|
|
|
225 |
|
|
dummy : |
226 |
|
|
|
227 |
|
|
# DO NOT DELETE |
228 |
|
|
include Make.dep |