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CombiningParticlePotentialParsing

Last change on this file since ff4fff9 was a95f5d, checked in by Frederik Heber <heber@…>, 9 years ago

Set version to 1.5.3.

MoleCuilder library is now 16:0:0.
Codename "" ().

Property mode set to 100644

File size: 16.7 KB

Rev	Line
[14de469]	1	# -- Autoconf --
	2	# Process this file with autoconf to produce a configure script.
	3
	4	AC_PREREQ(2.59)
[a95f5d]	5	AC_INIT(MoleCuilder, 1.5.3, [heber@ins.uni-bonn.de], [molecuilder], [http://trac.ins.uni-bonn.de/projects/molecuilder/])
[bf4b9f]	6	AC_CONFIG_AUX_DIR([build-aux])
[14de469]	7	AC_CONFIG_SRCDIR([src/builder.cpp])
[861874]	8	AC_CONFIG_HEADER([config.h libmolecuilder_config.h])
	9	AC_CONFIG_MACRO_DIR([m4])
[bf4b9f]	10	AC_CONFIG_SUBDIRS([LinearAlgebra])
[14de469]	11
[dc322a]	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)
[3b35e7]	15	AM_INIT_AUTOMAKE([dist-bzip2 1.5 parallel-tests color-tests tar-pax subdir-objects])
[14de469]	16
	17	# Checks for programs.
	18	AC_PROG_CXX
[54a746]	19	AC_PROG_INSTALL
[14de469]	20
[0cfc27]	21	# check for cppunit (taken from svn.apache.org/../xmlbeanscxx)
	22	AM_PATH_CPPUNIT(1.9.6)
	23	AM_CONDITIONAL(CONDCPPUNIT, test "$CPPUNIT_LIBS")
	24
[c015b3]	25	dnl Check if we have enable python
	26	# python module
	27	AC_MSG_CHECKING(whether to enable python module)
[f99714]	28	AC_ARG_ENABLE(
	29	[python],
	30	AS_HELP_STRING([--enable-python],[turn on python module [default=yes]]),
	31	enable_python=$enableval,
	32	enable_python="yes")
[c015b3]	33	AC_MSG_RESULT($enable_python)
	34	AS_IF([test x"$enable_python" != x"no"],[
	35	# Python (for boost::python)
	36	AM_PATH_PYTHON([2.2])
	37	AX_PYTHON
	38	AC_DEFINE(HAVE_PYTHON,1, ["Build python module and scripts."])
	39	])
	40	AM_CONDITIONAL([CONDPYTHON], [test x"$enable_python" != x"no"])
	41	AC_SUBST(HAVE_PYTHON)
	42
[74459a]	43	dnl Check whether no extra thread for ActionQueue shall be used
	44	AC_MSG_CHECKING(whether to enable ActionQueue's run thread)
	45	AC_ARG_ENABLE(
	46	[action_thread],
	47	AS_HELP_STRING([--enable-action-thread],[turn on extra run thread for ActionQueue [default=yes]]),
	48	enable_action_thread=$enableval,
	49	enable_action_thread="no"
	50	)
	51	AC_MSG_RESULT($enable_action_thread)
	52	AS_IF([test x"$enable_action_thread" != x"no"],[
	53	AC_DEFINE(HAVE_ACTION_THREAD,1, ["Have extra run thread for ActionQueue."])
	54	])
	55	AM_CONDITIONAL([CONDACTIONTHREAD], [test x"$enable_action_thread" != x"no"])
	56	AC_SUBST(HAVE_ACTION_THREAD)
	57
[c015b3]	58	dnl Check if we have enable qtgui
[e5cec4]	59	# Qt programs
[c015b3]	60	AC_MSG_CHECKING(whether to enable Qt-based GUI)
[f99714]	61	AC_ARG_ENABLE(
	62	[qtgui],
	63	AS_HELP_STRING([--enable-qtgui],[turn on Qt GUI compilation [default=yes]]),
	64	enable_qtgui=$enableval,
	65	enable_qtgui="yes")
[c015b3]	66	AC_MSG_RESULT($enable_qtgui)
	67	AS_IF([test x"$enable_qtgui" != x"no"],[
[93909a]	68	AC_ARG_WITH(
	69	[Qt-bin],
	70	[AS_HELP_STRING([--with-Qt-bin], [give path to Qt binaries])],
	71	[have_qtgui_path=$withval],
	72	have_qtgui_path="")
[196702]	73	AS_IF([test x"$have_qtgui_path" != x""],[
	74	AC_PATH_PROGS([QT_MOC],
	75	[moc-qt4 moc],
	76	[AC_MSG_ERROR(["Qts moc not found, please use --with-Qt-bin."])],
	77	[$have_qtgui_path]
	78	)
	79	AC_PATH_PROGS([QT_RCC],
	80	[rcc-qt4 rcc],
	81	[AC_MSG_ERROR(["Qts rcc not found, please use --with-Qt-bin."])],
	82	[$have_qtgui_path]
	83	)
	84	AC_PATH_PROGS([QT_UIC],
	85	[uic-qt4 uic],
	86	[AC_MSG_ERROR(["Qts uic not found, please use --with-Qt-bin."])],
	87	[$have_qtgui_path]
	88	)
	89	],[
	90	AC_PATH_PROGS([QT_MOC],
	91	[moc-qt4 moc],
	92	[AC_MSG_ERROR(["Qts moc not found, please use --with-Qt-bin."])]
	93	)
	94	AC_PATH_PROGS([QT_RCC],
	95	[rcc-qt4 rcc],
	96	[AC_MSG_ERROR(["Qts rcc not found, please use --with-Qt-bin."])]
	97	)
	98	AC_PATH_PROGS([QT_UIC],
	99	[uic-qt4 uic],
	100	[AC_MSG_ERROR(["Qts uic not found, please use --with-Qt-bin."])]
	101	)
	102	])
[c015b3]	103	PKG_CHECK_MODULES([QT], [QtCore QtGui Qt3D], [
	104	])
	105	AC_SUBST([QT_CFLAGS])
	106	AC_SUBST([QT_LIBS])
	107	AC_DEFINE(HAVE_QTGUI,1, ["Build Qt-based GUI"])
[e5cec4]	108	])
[c015b3]	109	AM_CONDITIONAL([CONDQTGUI], [test x"$enable_qtgui" != x"no"])
	110	AC_SUBST(HAVE_QTGUI)
[e5cec4]	111
[c76b8b]	112	# check additionally for QWT to enable plotting of potentials
	113	AC_MSG_CHECKING(whether to enable Qwt-based plotting)
	114	#enable_qwt=yes
	115	AC_ARG_ENABLE(
	116	[qwt],
	117	AS_HELP_STRING([--enable-qwt],[turn on Qwt compilation [default=yes]]),
	118	enable_qwt=$enableval,
	119	enable_qwt="yes")
	120	AC_MSG_RESULT($enable_qwt)
	121	AS_IF([test x"$enable_qwt" != x"no"],[
	122	MOL_AC_HAVE_QWT_IFELSE(
	123	[
	124	enable_qwt=yes
	125	AC_DEFINE(HAVE_QWT,1, ["Build Qwt-based plotting"])
	126	],
	127	[
	128	enable_qwt=no
	129	AC_MSG_WARN([Qwt not found, disabling plotting in QtUI.])
	130	]
	131	)
	132	])
	133	AM_CONDITIONAL([CONDQWT], [test x"$enable_qwt" != x"no"])
	134	AC_SUBST(HAVE_QWT)
	135
[ec188c]	136	# use doxygen
	137	DX_HTML_FEATURE(ON)
	138	DX_PS_FEATURE(OFF)
	139	DX_PDF_FEATURE(OFF)
[3158e6]	140	DX_INIT_DOXYGEN(MoleCuilder, Doxyfile, ${docdir})
[ec188c]	141
[6029a6]	142	# use docbook
	143	AX_CHECK_DOCBOOK
	144
[ec188c]	145	# use libtool
[a0064e]	146	LT_INIT([static])
[861874]	147
	148	# Define these substitions here to keep all version information in one place.
	149	# For information on how to properly maintain the library version information,
	150	# refer to the libtool manual, section "Updating library version information":
	151	# http://www.gnu.org/software/libtool/manual/html_node/Updating-version-info.html
[a95f5d]	152	AC_SUBST([MOLECUILDER_SO_VERSION], [16:0:0])
	153	AC_SUBST([MOLECUILDER_API_VERSION], [1.5.3])
[06aedc]	154
[dc031c]	155	dnl this macro is used to get the arguments supplied
	156	dnl to the configure script (./configure --enable-debug)
	157	dnl Check if we have enable debug support.
	158	AC_MSG_CHECKING(whether to enable debugging)
	159	have_debug="no"
[f99714]	160	AC_ARG_ENABLE(
	161	[debug],
	162	AS_HELP_STRING([--enable-debug],[turn on debugging [default=no]]),
	163	enable_debug=$enableval,
	164	enable_debug="no")
	165	AC_MSG_RESULT($enable_debug)
	166	AS_IF([test x"$enable_debug" = x"yes"],[
[dc031c]	167	AC_DEFINE(MEMDEBUG,1, ["Use memory debugger."])
	168	AC_DEFINE(HAVE_DEBUG,1, ["Use debug setting to compile code."])
	169	have_debug="yes"
[f99714]	170	],[
	171	AS_IF([test x"$enable_debug" = x"full"],[
	172	AC_DEFINE(MEMDEBUG,1, ["Use memory debugger."])
	173	AC_DEFINE(LOG_OBSERVER,1, ["Use observer log."])
	174	AC_DEFINE(HAVE_DEBUG,2, ["Use debug setting to compile code."])
[4d6d6a]	175	dnl AC_DEFINE(QT_DEBUG,, ["Enable Qt debug messages."])
[f99714]	176	have_debug="full"
	177	],[
	178	AC_DEFINE(NDEBUG,1, ["Don't compile in debugging code."])
	179	AC_DEFINE(HAVE_DEBUG,0, ["Use debug setting to compile code."])
[4d6d6a]	180	AC_DEFINE(QT_NO_DEBUG_OUTPUT,, ["Disable Qt debug messages."])
[f99714]	181	have_debug="no"
	182	])
	183	])
[dc031c]	184	AC_SUBST(HAVE_DEBUG)
	185
	186	dnl this macro is used to get the arguments supplied
	187	dnl to the configure script (./configure --enable-debug)
	188	dnl Check if we have enable debug support.
[f3b8a5]	189	AC_MSG_CHECKING(whether to enable internal caching/lazy evaluation)
[f99714]	190	AC_ARG_ENABLE(
	191	[cache],
	192	AS_HELP_STRING([--enable-cache],[turn on internal lazy evaluation [default=yes]]),
	193	enable_cache=$enableval,
	194	enable_cache="yes")
[f3b8a5]	195	AC_MSG_RESULT($enable_cache)
[f99714]	196	AS_IF([test x"$enable_cache" != x"no"],[
	197	AC_DEFINE(HAVE_CACHE,1, ["cache variables to speed up the code."])
	198	],[
[dc031c]	199	AC_DEFINE(NO_CACHING,1, ["Don't use caching code."])
	200	AC_DEFINE(HAVE_CACHE,0, ["cache variables to speed up the code."])
[f99714]	201	])
[dc031c]	202	AC_SUBST(HAVE_CACHE)
	203
[14de469]	204	# Checks for libraries.
[861874]	205	AC_CHECK_LIB(m, sqrt, , AC_MSG_ERROR([compatible libc math library not found]))
[14de469]	206
[7d0a4e]	207	# Pthreads
	208	ACX_PTHREAD()
	209
[f08ae7]	210	# Boost
[79de12]	211	BOOST_REQUIRE([1.40])
[f08ae7]	212
	213	# Boost headers only
	214	BOOST_ANY
[794bc8]	215	BOOST_ARRAY
[4f04ab8]	216	BOOST_BIMAP
[f08ae7]	217	BOOST_BIND
[503acc1]	218	BOOST_CAST
[f08ae7]	219	BOOST_CONVERSION
[79de12]	220	BOOST_EXCEPTION
[f08ae7]	221	BOOST_FOREACH
	222	BOOST_FUNCTION
[619a0e]	223	BOOST_FUSION
[4f04ab8]	224	BOOST_GRAPH
[30c753]	225	BOOST_ITERATOR
[794bc8]	226	BOOST_MULTIARRAY
[4da4de]	227	BOOST_MULTIINDEXCONTAINER
[619a0e]	228	BOOST_MPL
[f08ae7]	229	BOOST_PREPROCESSOR
	230	BOOST_RANDOM
	231	BOOST_SMART_PTR
[7f570c]	232	BOOST_STRING_ALGO
[f08ae7]	233	BOOST_TOKENIZER
	234
	235	# Boost headers with libraries
[79de12]	236	BOOST_FILESYSTEM
[d920b9]	237	BOOST_IOSTREAMS
[79de12]	238	BOOST_PROGRAM_OPTIONS
[c015b3]	239	AS_IF([test x"$enable_python" != x"no"], [BOOST_PYTHON])
[d7d022]	240	BOOST_SERIALIZATION
[79de12]	241	BOOST_THREADS
[fa861b]	242
[f08ae7]	243
[e2c2b1]	244	# CodePatterns library (requiring UnobservedIterator)
	245	AM_PATH_CODEPATTERNS([1.3.1], $have_debug,,[AC_MSG_ERROR([Missing CodePatterns library, please specify PKG_CONFIG_PATH or use --with-codepatterns...])])
[3027f8]	246
[004d5c]	247	# JobMarket library (needs boost/archive/iserializer.hpp before MemDebug.hpp)
[830adf]	248	AC_MSG_CHECKING(whether to enable jobmarket)
[004d5c]	249	AC_ARG_ENABLE(
	250	[jobmarket],
	251	AS_HELP_STRING([--enable-jobmarket],[turn on JobMarket feature [default=yes]]),
	252	enable_jobmarket=$enableval,
	253	enable_jobmarket="yes")
	254	AC_MSG_RESULT($enable_jobmarket)
	255	AS_IF([test x"$enable_jobmarket" != x"no"],[
[d6a7b9]	256	# JobMarket library (needs SystemCommandJob with suffix)
	257	AM_PATH_JOBMARKET([1.1.5], $have_debug,[
[004d5c]	258	# the following is only required if we have JobMarket
	259	BOOST_ASIO
	260	AC_DEFINE(HAVE_JOBMARKET,1, ["use JobMarket to calculate fragment jobs."])
	261	],[
	262	enable_jobmarket="no"
	263	])
	264	]
	265	#[
	266	# AC_DEFINE(HAVE_JOBMARKET,0, ["use JobMarket to calculate fragment jobs."])
	267	#]
	268	)
	269	AC_SUBST(HAVE_JOBMARKET)
	270	AM_CONDITIONAL([CONDJOBMARKET], [test x"$enable_jobmarket" = x"yes"])
[3027f8]	271
[d2a0f6d]	272	# VMG library
	273	AC_MSG_CHECKING(whether to compile in long-range support via VMG)
	274	AC_ARG_ENABLE(
	275	[vmg],
	276	[AS_HELP_STRING([--enable-vmg], [turn on long-range potential calculation via VMG [default=no]])],
	277	[enable_vmg=$enableval],
	278	enable_vmg="no")
	279	AC_MSG_RESULT($enable_vmg)
	280	AS_IF([test x"$enable_vmg" != x"no"],[
	281	PKG_CHECK_MODULES(VMG, VMG >= 0.1)
	282	AC_SUBST(VMG_CFLAGS)
	283	AC_SUBST(VMG_LIBS)
[69c733]	284	AC_DEFINE(HAVE_VMG,1, ["use VMG to calculate long-range contributions."])
[8a8c8c]	285
	286	# check whether to use mpi
	287	AC_ARG_WITH(
	288	[vmg-mpi],
	289	[AS_HELP_STRING([--with-vmg-mpi], [whether to use MPI for communication in VMGJobs])],
	290	[with_vmg_mpi=yes],
	291	[with_vmg_mpi=no])
	292	AS_IF(
	293	[test "x$with_vmg_mpi" != xno],
	294	[
	295	AC_LANG_SAVE
	296	AC_LANG_CPLUSPLUS
	297	LX_FIND_MPI
	298	AC_LANG_RESTORE
	299	AS_IF([test "x$have_CXX_mpi" = xyes],[
	300	AC_DEFINE([MPICH_SKIP_MPICXX], [1], [Skip C++ bindings])
	301	AC_DEFINE([OMPI_SKIP_MPICXX], [1], [Skip C++ bindings])
	302	AC_DEFINE([MPI_NO_CPPBIND], [1], [Skip C++ bindings])
	303	AC_DEFINE([_MPICC_H], [1], [Skip C++ bindings])
	304	AC_DEFINE([MPIBULL_SKIP_MPICXX], [1], [Skip C++ bindings])
	305	])
	306	],
	307	[])
[d2a0f6d]	308	])
	309	AM_CONDITIONAL([CONDVMG], [test x"$enable_vmg" = x"yes"])
[8a8c8c]	310	AM_CONDITIONAL([CONDVMGMPI], [test x"$have_CXX_mpi" = x"yes"])
[d2a0f6d]	311
	312
[f06d52]	313	# Check for Levenberg-Marquardt implementation
[830adf]	314	AC_MSG_CHECKING(whether to enable function fitting via levmar)
[48d20d]	315	AC_ARG_ENABLE(
	316	[levmar],
	317	AS_HELP_STRING([--enable-levmar],[turn on LevMar feature [default=no]]),
	318	enable_levmar=$enableval,
	319	enable_levmar="no")
[4d5dfa]	320	AC_MSG_RESULT($enable_levmar)
[b61bd5]	321	# don't use AS_IF here as it expands (and tests) AC_F77_FUN even if levmar
[4d5dfa]	322	# is disabled.
[b61bd5]	323	if test x"$enable_levmar" = xyes; then
	324	AX_LAPACK([enable_levmar=yes],
	325	[enable_levmar=no
	326	AC_MSG_WARN(["Missing LAPACK, disabling off levmar"])
	327	]
	328	)
[4d5dfa]	329	fi
[b61bd5]	330	AS_IF([test x"$enable_levmar" = xyes],[
	331	AC_MSG_CHECKING(for levmar presence via given path )
[f06d52]	332	AC_ARG_WITH(
	333	[levmar],
	334	[AS_HELP_STRING([--with-levmar], [give path to LevMar package])],
[b61bd5]	335	[have_levmar_path=$withval
	336	enable_levmar=yes],
[f06d52]	337	[enable_levmar=no])
[b61bd5]	338	AC_MSG_RESULT($enable_levmar)
	339	AS_IF([test -n "$have_levmar_path"],[
	340	LEVMAR_CPPFLAGS="-I${have_levmar_path}/include"
	341	LEVMAR_LDFLAGS="-L${have_levmar_path}/lib"
	342	LEVMAR_LIBS="-llevmar"],[
	343	PKG_CHECK_MODULES([LEVMAR],[levmar],[enable_levmar=yes],[
	344	AC_MSG_CHECKING(for levmar presence via locate)
	345	enable_levmar=no
	346	levmar_lib=`locate liblevmar.a \| head -n 1 \| xargs dirname`
	347	levmar_include=`locate levmar.h \| head -n 1 \| xargs dirname`
	348	if test -n "$levmar_lib"; then
	349	if test -n "$levmar_include"; then
	350	enable_levmar=yes
	351	LEVMAR_CPPFLAGS="-I${levmar_include}"
	352	LEVMAR_LDFLAGS="-L${levmar_lib}"
	353	LEVMAR_LIBS="-llevmar"
	354	fi
	355	fi
	356	AC_MSG_RESULT($enable_levmar)
	357	])
	358	])
	359	],[enable_levmar=no]
	360	)
	361	AC_MSG_CHECKING(for levmar usability)
	362	AS_IF([test x"$enable_levmar" = xyes],[
[f06d52]	363	AC_SUBST(LEVMAR_CPPFLAGS)
	364	AC_SUBST(LEVMAR_LDFLAGS)
	365	AC_SUBST(LEVMAR_LIBS)
[b61bd5]	366	AC_DEFINE(HAVE_LEVMAR,1, ["use levmar for non-linear minimisation/potential fitting."])])
	367	AC_MSG_RESULT($enable_levmar)
[f06d52]	368	AM_CONDITIONAL([CONDLEVMAR], [test x"$enable_levmar" = x"yes"])
	369
[14de469]	370	# Checks for header files.
	371	AC_HEADER_STDC
	372	AC_CHECK_HEADERS([sys/time.h])
	373	AC_HEADER_STDBOOL
	374
[d3a46d]	375	AC_FUNC_MALLOC
	376	AC_FUNC_REALLOC
	377	AC_CHECK_FUNCS([floor pow sqrt strchr])
	378
[14de469]	379	# Checks for typedefs, structures, and compiler characteristics.
	380	AC_C_CONST
	381	AC_C_INLINE
	382	AC_C_RESTRICT
	383	AC_TYPE_SIZE_T
	384
	385	# Checks for library functions.
	386	# check for GNU Scientific Library
[bd3e55]	387	AC_CHECK_HEADERS([gsl/gsl_blas.h])
[db1a72]	388	AC_SEARCH_LIBS(dnrm2, gslblas gslcblas goto blas cblas)
	389	AC_SEARCH_LIBS(cblas_dnrm2, gslblas gslcblas blas cblas)
	390	AC_SEARCH_LIBS(gsl_blas_dnrm2,, gsl)
	391	#AC_CHECK_LIB(gsl, gsl_blas_dnrm2, , [AC_MSG_ERROR(["No working BLAS found for GSL, stopping."])])
	392	AC_CHECK_LIB(gsl, main)
[14de469]	393
[490038]	394	# use CppUnit TestRunner or not
[f99714]	395	AC_MSG_CHECKING(whether to enable ECut TestRunnerClient)
	396	AC_ARG_ENABLE(
	397	[ecut],
	398	AS_HELP_STRING([--enable-ecut],[Use ECut TestRunnerClient [default=no]]),
	399	enable_ecut=$disableval,
	400	enable_ecut="no")
	401	AC_MSG_RESULT($enable_ecut)
	402	AS_IF([test x"$enable_ecut" = x"yes"],[
[9b6b2f]	403	AC_DEFINE(HAVE_ECUT,1, ["Use ECut TestRunnerClient instead of our own."])
	404	AC_SUBST(HAVE_ECUT)
[f99714]	405	])
[fbbcde]	406	AM_CONDITIONAL([CONDECUT], [test x"$enable_ecut" = x"yes"])
[9b6b2f]	407
[490038]	408	# with valgrinding testsuite or not
[f3b8a5]	409	AC_MSG_CHECKING(whether to enable valgrind memory checking in testsuite)
[f99714]	410	AC_ARG_ENABLE(
	411	[valgrind],
	412	AS_HELP_STRING([--enable-valgrind],[Use Valgrind on the testsuite [default=no]]),
	413	enable_valgrind=$enableval,
	414	enable_valgrind="no")
	415	AC_MSG_RESULT($enable_valgrind)
	416	AS_IF([test x"$enable_valgrind" = x"yes"], [
[490038]	417	AC_CHECK_HEADER([valgrind/valgrind.h],
	418	[
	419	# check header
	420	AC_DEFINE(HAVE_VALGRIND_TESTSUITE,1, ["Use Valgrind to check the testsuite."])
	421	# check path
	422	AC_PATH_PROG(VALGRIND, [valgrind], [/bin/false])
	423	# set variables
	424	AC_SUBST(HAVE_VALGRIND_TESTSUITE)
	425	AC_SUBST(VALGRIND)
	426	],
	427	[
	428	AC_MSG_ERROR(["Valgrind support requested but headers not available."])
	429	]
	430	)
[f3b8a5]	431	])
[490038]	432
[14de469]	433	# Check for "extern inline", using a modified version
	434	# of the test for AC_C_INLINE from acspecific.mt
	435	AC_CACHE_CHECK([for extern inline], ac_cv_c_extern_inline,
	436	[ac_cv_c_extern_inline=no
	437	AC_TRY_COMPILE([extern $ac_cv_c_inline double foo(double x);
	438	extern $ac_cv_c_inline double foo(double x) { return x+1.0; };
	439	double foo (double x) { return x + 1.0; };],
	440	[ foo(1.0) ],
	441	[ac_cv_c_extern_inline="yes"])
	442	])
	443
	444	if test "$ac_cv_c_inline" != no ; then
	445	AC_DEFINE(HAVE_INLINE,1, ["May use inline routines"])
	446	AC_SUBST(HAVE_INLINE)
	447	fi
	448
[bd3e55]	449	#AC_MSG_NOTICE(["CFLAGS: $CFLAGS, CXXFLAGS: $CXXFLAGS, LDFLAGS: $LDFLAGS, CC: $CC, CXX:, $CXX, MPICC: $MPICC, MPILIBS: $MPILIBS, LIBS: $LIBS"])
[a19da5d]	450
[0ca39c]	451	# test suite
[878044]	452
[5079a0]	453	AC_CONFIG_FILES([
[689639]	454	tests/Makefile])
	455
[abfc95]	456	AC_CONFIG_TESTDIR(tests/Calculations)
	457	AC_CONFIG_FILES([
	458	tests/Calculations/atlocal
	459	tests/Calculations/Makefile])
	460	AC_CONFIG_FILES([tests/Calculations/molecuilder], [chmod +x tests/Calculations/molecuilder])
	461
[689639]	462	AC_CONFIG_TESTDIR(tests/CodeChecks)
[d0a719]	463	AC_CONFIG_FILES([
	464	tests/CodeChecks/atlocal
	465	tests/CodeChecks/Makefile])
[689639]	466
[740d40]	467	AC_CONFIG_TESTDIR(tests/Fragmentations)
[038713]	468	AC_CONFIG_FILES([
[740d40]	469	tests/Fragmentations/atlocal
	470	tests/Fragmentations/Makefile])
	471	AC_CONFIG_FILES([tests/Fragmentations/molecuilder], [chmod +x tests/Fragmentations/molecuilder])
[689639]	472
[0f0407]	473	AC_CONFIG_TESTDIR(tests/GuiChecks)
	474	AC_CONFIG_FILES([
	475	tests/GuiChecks/atlocal
	476	tests/GuiChecks/Makefile])
	477	AC_CONFIG_FILES([tests/GuiChecks/molecuilder], [chmod +x tests/GuiChecks/molecuilder])
	478	AC_CONFIG_FILES([tests/GuiChecks/molecuilderguitest], [chmod +x tests/GuiChecks/molecuilderguitest])
[c66ae6]	479	AC_CONFIG_FILES([tests/GuiChecks/adjacencymatcher], [chmod +x tests/GuiChecks/adjacencymatcher])
[42b40a]	480	AC_CONFIG_FILES([tests/GuiChecks/trianglematcher], [chmod +x tests/GuiChecks/trianglematcher])
[0f0407]	481
[004d5c]	482	AC_CONFIG_TESTDIR(tests/JobMarket)
	483	AC_CONFIG_FILES([
	484	tests/JobMarket/atlocal
	485	tests/JobMarket/Makefile])
	486	AC_CONFIG_FILES([tests/JobMarket/molecuilder], [chmod +x tests/JobMarket/molecuilder])
	487
[689639]	488	AC_CONFIG_TESTDIR(tests/regression)
	489	AC_CONFIG_FILES([
	490	tests/regression/atlocal
	491	tests/regression/Makefile])
	492	AC_CONFIG_FILES([tests/regression/molecuilder], [chmod +x tests/regression/molecuilder])
[c66ae6]	493	AC_CONFIG_FILES([tests/regression/adjacencymatcher], [chmod +x tests/regression/adjacencymatcher])
[7d146a]	494	AC_CONFIG_FILES([tests/regression/trianglematcher], [chmod +x tests/regression/trianglematcher])
[893426]	495	AC_CONFIG_FILES([tests/regression/runpython], [chmod +x tests/regression/runpython])
[689639]	496
	497	AC_CONFIG_TESTDIR(tests/Tesselations)
[5079a0]	498	AC_CONFIG_FILES([
[a85f45]	499	tests/Tesselations/atlocal
	500	tests/Tesselations/Makefile])
	501	AC_CONFIG_FILES([tests/Tesselations/molecuilder], [chmod +x tests/Tesselations/molecuilder])
[7d146a]	502	AC_CONFIG_FILES([tests/Tesselations/trianglematcher], [chmod +x tests/Tesselations/trianglematcher])
[689639]	503
[5079a0]	504	AC_CONFIG_FILES([
	505	doc/molecuilder.xml])
[6029a6]	506	AC_CONFIG_FILES([
	507	doc/userguide/catalog.xml:doc/userguide/catalog.xml.in])
[861874]	508	AC_CONFIG_FILES([
[878044]	509	MoleCuilder.pc:MoleCuilder.pc.in])
[5079a0]	510	AC_CONFIG_FILES([
[ec188c]	511	doc/Makefile
[6029a6]	512	doc/userguide/Makefile
	513	])
	514	AC_CONFIG_FILES([
	515	Makefile
[938ffd]	516	src/Makefile
[c66ae6]	517	src/Bond/AdjacencyMatcher/Makefile
[7d146a]	518	src/Tesselation/TriangleMatcher/Makefile
[5b991a]	519	data/icons/Makefile
[04e1fb]	520	utils/Makefile
[85949a]	521	])
	522	AC_CONFIG_FILES([
[878044]	523	src/unittests/Makefile
[85949a]	524	])
[d0b3aca]	525
[c015b3]	526	# produce python scripts and tests only when python's present
[24e19e]	527	AC_CONFIG_TESTDIR([tests/Python])
	528	AC_CONFIG_FILES([tests/Python/atlocal])
[c015b3]	529	AM_COND_IF([CONDPYTHON],[
[9fd196]	530	AC_CONFIG_FILES([utils/Python/boxmaker.py:utils/Python/boxmaker.py.in], [chmod +x utils/Python/boxmaker.py])
	531	AC_CONFIG_FILES([utils/Python/python_wrapper:utils/Python/python_wrapper.in], [chmod +x utils/Python/python_wrapper])
[c015b3]	532	AC_CONFIG_FILES([tests/Python/run], [chmod +x tests/Python/run])
	533	])
[24e19e]	534	AC_CONFIG_FILES([tests/Python/Makefile])
[d0b3aca]	535
[14de469]	536	AC_OUTPUT

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