source: configure.ac@ 710dde

Action_Thermostats Add_AtomRandomPerturbation Add_FitFragmentPartialChargesAction Add_RotateAroundBondAction Add_SelectAtomByNameAction Added_ParseSaveFragmentResults AddingActions_SaveParseParticleParameters Adding_Graph_to_ChangeBondActions Adding_MD_integration_tests Adding_ParticleName_to_Atom Adding_StructOpt_integration_tests AtomFragments Automaking_mpqc_open AutomationFragmentation_failures Candidate_v1.5.4 Candidate_v1.6.0 Candidate_v1.6.1 ChangeBugEmailaddress ChangingTestPorts ChemicalSpaceEvaluator CombiningParticlePotentialParsing Combining_Subpackages Debian_Package_split Debian_package_split_molecuildergui_only Disabling_MemDebug Docu_Python_wait EmpiricalPotential_contain_HomologyGraph EmpiricalPotential_contain_HomologyGraph_documentation Enable_parallel_make_install Enhance_userguide Enhanced_StructuralOptimization Enhanced_StructuralOptimization_continued Example_ManyWaysToTranslateAtom Exclude_Hydrogens_annealWithBondGraph FitPartialCharges_GlobalError Fix_BoundInBox_CenterInBox_MoleculeActions Fix_ChargeSampling_PBC Fix_ChronosMutex Fix_FitPartialCharges Fix_FitPotential_needs_atomicnumbers Fix_ForceAnnealing Fix_IndependentFragmentGrids Fix_ParseParticles Fix_ParseParticles_split_forward_backward_Actions Fix_PopActions Fix_QtFragmentList_sorted_selection Fix_Restrictedkeyset_FragmentMolecule Fix_StatusMsg Fix_StepWorldTime_single_argument Fix_Verbose_Codepatterns Fix_fitting_potentials Fixes ForceAnnealing_goodresults ForceAnnealing_oldresults ForceAnnealing_tocheck ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_continued ForceAnnealing_with_BondGraph_continued_betteresults ForceAnnealing_with_BondGraph_contraction-expansion FragmentAction_writes_AtomFragments FragmentMolecule_checks_bonddegrees GeometryObjects Gui_Fixes Gui_displays_atomic_force_velocity ImplicitCharges IndependentFragmentGrids IndependentFragmentGrids_IndividualZeroInstances IndependentFragmentGrids_IntegrationTest IndependentFragmentGrids_Sole_NN_Calculation JobMarket_RobustOnKillsSegFaults JobMarket_StableWorkerPool JobMarket_unresolvable_hostname_fix MoreRobust_FragmentAutomation ODR_violation_mpqc_open PartialCharges_OrthogonalSummation PdbParser_setsAtomName PythonUI_with_named_parameters QtGui_reactivate_TimeChanged_changes Recreated_GuiChecks Rewrite_FitPartialCharges RotateToPrincipalAxisSystem_UndoRedo SaturateAtoms_findBestMatching SaturateAtoms_singleDegree StoppableMakroAction Subpackage_CodePatterns Subpackage_JobMarket Subpackage_LinearAlgebra Subpackage_levmar Subpackage_mpqc_open Subpackage_vmg Switchable_LogView ThirdParty_MPQC_rebuilt_buildsystem TrajectoryDependenant_MaxOrder TremoloParser_IncreasedPrecision TremoloParser_MultipleTimesteps TremoloParser_setsAtomName Ubuntu_1604_changes stable
Last change on this file since 710dde was dc322a, checked in by Frederik Heber <heber@…>, 14 years ago

DISTFIX: need to use tar-pax to allow for longer filenames in dist's archive.

  • Property mode set to 100644
File size: 7.7 KB
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1# -*- Autoconf -*-
2# Process this file with autoconf to produce a configure script.
3
4AC_PREREQ(2.59)
5AC_INIT(MoleCuilder, 1.1.2, [heber@ins.uni-bonn.de], [molecuilder], [http://trac.ins.uni-bonn.de/projects/molecuilder/])
6AC_CONFIG_AUX_DIR([build-aux])
7AC_CONFIG_SRCDIR([src/builder.cpp])
8AC_CONFIG_HEADER([config.h libmolecuilder_config.h])
9AC_CONFIG_MACRO_DIR([m4])
10AC_CONFIG_SUBDIRS([LinearAlgebra])
11
12# parallel-tests: use parallel test druver
13# color-tests: us coloring to indicate success/failure when available
14# tar-pax: use newer tar implementation with longer filename (>99 chars)
15AM_INIT_AUTOMAKE([dist-bzip2 1.11 parallel-tests color-tests tar-pax])
16
17# Checks for programs.
18AM_PATH_CPPUNIT(1.9.6)
19AC_PROG_CXX
20AC_PROG_CC
21AC_PROG_INSTALL
22AC_CHECK_PROG([LATEX],[latex],[latex],[:])
23AC_CHECK_PROG([BIBTEX],[bibtex],[bibtex],[:])
24AC_CHECK_PROG([DVIPS],[dvips],[dvips],[:])
25AC_CHECK_PROG([PDFLATEX],[pdflatex],[pdflatex],[:])
26AC_CHECK_PROG([XMLTO],[xmlto],[xmlto],[:])
27AM_MISSING_PROG([DOXYGEN], [doxygen])
28
29LT_INIT([static])
30
31# Define these substitions here to keep all version information in one place.
32# For information on how to properly maintain the library version information,
33# refer to the libtool manual, section "Updating library version information":
34# http://www.gnu.org/software/libtool/manual/html_node/Updating-version-info.html
35AC_SUBST([MOLECUILDER_SO_VERSION], [4:0:0])
36AC_SUBST([MOLECUILDER_API_VERSION], [1.1.2])
37
38# for libLinearAlgebra
39AC_SUBST([LINEARALGEBRA_SO_VERSION], [1:0:0])
40
41dnl this macro is used to get the arguments supplied
42dnl to the configure script (./configure --enable-debug)
43dnl Check if we have enable debug support.
44AC_MSG_CHECKING(whether to enable debugging)
45default="no"
46have_debug="no"
47AC_ARG_ENABLE(debug, [ --enable-debug=[no/yes/full] turn on debugging
48 [default=$default]],, enable_debug=$default)
49if test "x$enable_debug" = "xyes"; then
50 AC_DEFINE(MEMDEBUG,1, ["Use memory debugger."])
51 AC_DEFINE(HAVE_DEBUG,1, ["Use debug setting to compile code."])
52 have_debug="yes"
53elif test "x$enable_debug" = "xfull"; then
54 AC_DEFINE(MEMDEBUG,1, ["Use memory debugger."])
55 AC_DEFINE(LOG_OBSERVER,1, ["Use observer log."])
56 AC_DEFINE(HAVE_DEBUG,2, ["Use debug setting to compile code."])
57 have_debug="full"
58else
59 AC_DEFINE(NDEBUG,1, ["Don't compile in debugging code."])
60 AC_DEFINE(HAVE_DEBUG,0, ["Use debug setting to compile code."])
61 have_debug="no"
62fi
63AC_MSG_RESULT($have_debug)
64AC_SUBST(HAVE_DEBUG)
65
66dnl this macro is used to get the arguments supplied
67dnl to the configure script (./configure --enable-debug)
68dnl Check if we have enable debug support.
69AC_MSG_CHECKING([whether to enable internal caching of values (speedup!)])
70default="yes"
71AC_ARG_ENABLE(cache, [ --enable-cache=[no/yes] turn on caching
72 [default=$default]],, enable_cache=$default)
73if test "x$enable_cache" = "xno"; then
74 AC_DEFINE(NO_CACHING,1, ["Don't use caching code."])
75 AC_DEFINE(HAVE_CACHE,0, ["cache variables to speed up the code."])
76 AC_MSG_RESULT(no)
77else
78 AC_DEFINE(HAVE_CACHE,1, ["cache variables to speed up the code."])
79 AC_MSG_RESULT(yes)
80fi
81AC_SUBST(HAVE_CACHE)
82
83#AC_MSG_CHECKING(whether to enable profiling)
84#default="no"
85#AC_ARG_ENABLE(debug, [ --enable-profile=[no/yes] turn on profiling
86# [default=$default]],, enable_profile=$default)
87#if test "x$enable_profile" = "xyes"; then
88# CXXFLAGS="$CXXFLAGS -g -DDEBUG -pg"
89# DEBUG=-pg;
90# AC_MSG_RESULT(yes)
91#else
92# AC_MSG_RESULT(no)
93#fi
94
95#AC_MSG_CHECKING(whether to enable serialization)
96#default="no"
97#AC_ARG_ENABLE(debug, [ --enable-serialization=[no/yes] turn on serialization support
98# [default=$default]],, enable_serialization=$default)
99#if test "x$enable_serialization" = "xyes"; then
100# CXXFLAGS="$CXXFLAGS -DSERIALIZATION"
101# serialization=yes;
102# AC_MSG_RESULT(yes)
103#else
104# serialization=no;
105# AC_MSG_RESULT(no)
106#fi
107
108# Checks for libraries.
109AC_CHECK_LIB(m, sqrt, , AC_MSG_ERROR([compatible libc math library not found]))
110
111# Boost libraries
112AX_BOOST_BASE([1.40])
113AX_BOOST_PROGRAM_OPTIONS
114AX_BOOST_SYSTEM
115AX_BOOST_FILESYSTEM
116AX_BOOST_THREAD
117#AX_BOOST_SERIALIZATION
118
119#QT4 libraries
120gw_CHECK_QT4
121AX_CHECK_GLU
122#AC_MSG_NOTICE(["GLU_CFLAGS: $GLU_CFLAGS, GLU_CXXFLAGS: $GLU_CXXFLAGS, GLU_LDFLAGS: $GLU_LDFLAGS, GLU_LIBS: $GLU_LIBS"])
123
124# CodePatterns library (needs operator<<(.., range<>) )
125AM_PATH_CODEPATTERNS([1.0.13], $have_debug,,[AC_MSG_ERROR([Missing CodePatterns library, please specify PKG_CONFIG_PATH or use --with-codepatterns...])])
126
127# Checks for header files.
128AC_HEADER_STDC
129AC_CHECK_HEADERS([sys/time.h])
130AC_HEADER_STDBOOL
131
132AC_FUNC_MALLOC
133AC_FUNC_REALLOC
134AC_CHECK_FUNCS([floor pow sqrt strchr])
135
136# Checks for typedefs, structures, and compiler characteristics.
137AC_C_CONST
138AC_C_INLINE
139AC_C_RESTRICT
140AC_TYPE_SIZE_T
141
142# Checks for library functions.
143# check for GNU Scientific Library
144AC_CHECK_HEADERS([gsl/gsl_blas.h])
145AC_SEARCH_LIBS(dnrm2, goto blas cblas gslblas gslcblas)
146AC_CHECK_LIB(gsl, main, [],
147 [AC_SEARCH_LIBS(cblas_dnrm2, blas cblas gslblas gslcblas)])
148AC_CHECK_LIB(gsl, gsl_blas_dnrm2, , [AC_MSG_ERROR(["No working BLAS found for GSL, stopping."])])
149
150# add replacement/saturation hydrogen or not
151AC_ARG_ENABLE([hydrogen],AS_HELP_STRING([--enable-hydrogen],[Adding saturation hydrogen (default is yes)]),
152 [enable_hydrogen=$enableval], [enable_hydrogen=yes])
153if test x"$enable_hydrogen" = xyes; then
154 AC_DEFINE(ADDHYDROGEN,1, ["Adding saturation hydrogen"])
155 AC_SUBST(ADDHYDROGEN)
156fi
157
158# use CppUnit TestRunner or not
159AC_ARG_ENABLE([ecut],AS_HELP_STRING([--enable-ecut],[Use ECut TestRunnerClient (default is no)]),
160 [enable_ecut=$enableval], [enable_ecut=no])
161if test x"$enable_ecut" = xyes; then
162 AC_DEFINE(HAVE_ECUT,1, ["Use ECut TestRunnerClient instead of our own."])
163 AC_SUBST(HAVE_ECUT)
164fi
165
166# with valgrinding testsuite or not
167AC_ARG_WITH([valgrind],AS_HELP_STRING([--with-valgrind],[Use Valgrind on the testsuite (default is no)]),
168 [with_valgrind=$withval], [with_valgrind=no])
169if test x"$with_valgrind" = xyes; then
170 AC_CHECK_HEADER([valgrind/valgrind.h],
171 [
172 # check header
173 AC_DEFINE(HAVE_VALGRIND_TESTSUITE,1, ["Use Valgrind to check the testsuite."])
174 # check path
175 AC_PATH_PROG(VALGRIND, [valgrind], [/bin/false])
176 # set variables
177 AC_SUBST(HAVE_VALGRIND_TESTSUITE)
178 AC_SUBST(VALGRIND)
179 ],
180 [
181 AC_MSG_ERROR(["Valgrind support requested but headers not available."])
182 ]
183 )
184fi
185
186# Check for "extern inline", using a modified version
187# of the test for AC_C_INLINE from acspecific.mt
188AC_CACHE_CHECK([for extern inline], ac_cv_c_extern_inline,
189[ac_cv_c_extern_inline=no
190AC_TRY_COMPILE([extern $ac_cv_c_inline double foo(double x);
191extern $ac_cv_c_inline double foo(double x) { return x+1.0; };
192double foo (double x) { return x + 1.0; };],
193[ foo(1.0) ],
194[ac_cv_c_extern_inline="yes"])
195])
196
197if test "$ac_cv_c_inline" != no ; then
198 AC_DEFINE(HAVE_INLINE,1, ["May use inline routines"])
199 AC_SUBST(HAVE_INLINE)
200fi
201
202#AC_MSG_NOTICE(["CFLAGS: $CFLAGS, CXXFLAGS: $CXXFLAGS, LDFLAGS: $LDFLAGS, CC: $CC, CXX:, $CXX, MPICC: $MPICC, MPILIBS: $MPILIBS, LIBS: $LIBS"])
203
204# test suite
205AC_CONFIG_TESTDIR(tests/regression)
206AC_CONFIG_FILES([
207 tests/Makefile
208 tests/regression/atlocal
209 tests/regression/Makefile])
210AC_CONFIG_FILES([tests/regression/molecuilder], [chmod +x tests/regression/molecuilder])
211AC_CONFIG_FILES([
212 tests/CodeChecks/atlocal
213 tests/CodeChecks/Makefile])
214AC_CONFIG_FILES([
215 tests/Fragmentations/Makefile
216 tests/Fragmentations/defs])
217AC_CONFIG_FILES([
218 tests/Tesselations/Makefile
219 tests/Tesselations/defs])
220AC_CONFIG_FILES([
221 doc/molecuilder.xml])
222AC_CONFIG_FILES([
223 MoleCuilder.pc:MoleCuilder.pc.in])
224AC_CONFIG_FILES([
225 Makefile
226 doc/Makefile
227 src/Makefile
228])
229AC_CONFIG_FILES([
230 src/unittests/Makefile
231])
232AC_OUTPUT
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