source: configure.ac@ 5079a0

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 5079a0 was 5079a0, checked in by Frederik Heber <heber@…>, 15 years ago

Actions put into libMolecuilderActions, UIElements into libMolecuilderUI

  • due to great number of Actions it is sensible to put them into their own library
  • this is advantageous overall, but right now especially as all the unit tests do not depend on this lib.
  • it was also needed as Actions depend on UIElements and to resolve to correct ordering, UIElements have to be available before the libMolecuilderActions is aded (if compiled into libmolecuilder it is appended after!)
  • Property mode set to 100644
File size: 3.3 KB
Line 
1# -*- Autoconf -*-
2# Process this file with autoconf to produce a configure script.
3
4AC_PREREQ(2.59)
5AC_INIT(Molecuilder, 1.0, heber@ins.uni-bonn.de, molecuilder)
6AC_CONFIG_AUX_DIR(config)
7AC_CONFIG_SRCDIR([src/builder.cpp])
8AC_CONFIG_HEADER([config.h])
9
10AM_INIT_AUTOMAKE(dist-bzip2)
11
12# Checks for programs.
13AM_PATH_CPPUNIT(1.9.6)
14AC_PROG_CXX
15AC_PROG_CC
16AC_PROG_RANLIB
17AC_PROG_INSTALL
18AC_CHECK_PROG([LATEX],[latex],[latex],[:])
19AC_CHECK_PROG([BIBTEX],[bibtex],[bibtex],[:])
20AC_CHECK_PROG([DVIPS],[dvips],[dvips],[:])
21AC_CHECK_PROG([PDFLATEX],[pdflatex],[pdflatex],[:])
22AC_CHECK_PROG([XMLTO],[xmlto],[xmlto],[:])
23AM_MISSING_PROG([DOXYGEN], [doxygen])
24
25# Checks for libraries.
26AC_CHECK_LIB(m, sqrt, ,AC_MSG_ERROR([compatible libc math library not found]))
27
28# Boost libraries
29AX_BOOST_BASE([1.33.1])
30AX_BOOST_PROGRAM_OPTIONS
31#AX_BOOST_FOREACH
32#AX_BOOST_FILESYSTEM
33AX_BOOST_THREAD
34#AX_BOOST_PROGRAM_OPTIONS
35#AX_BOOST_SERIALIZATION
36
37# Checks for header files.
38AC_HEADER_STDC
39AC_CHECK_HEADERS([sys/time.h])
40AC_HEADER_STDBOOL
41
42AC_FUNC_MALLOC
43AC_FUNC_REALLOC
44AC_CHECK_FUNCS([floor pow sqrt strchr])
45
46# Checks for typedefs, structures, and compiler characteristics.
47AC_C_CONST
48AC_C_INLINE
49AC_C_RESTRICT
50AC_TYPE_SIZE_T
51
52# Checks for library functions.
53# check for GNU Scientific Library
54AC_CHECK_HEADERS([gsl/gsl_blas.h])
55AC_SEARCH_LIBS(dnrm2, goto blas cblas gslblas gslcblas)
56AC_CHECK_LIB(gsl, main, [],
57 [AC_SEARCH_LIBS(cblas_dnrm2, blas cblas gslblas gslcblas)])
58AC_CHECK_LIB(gsl, gsl_blas_dnrm2, , [AC_MSG_ERROR(["No working BLAS found for GSL, stopping."])])
59
60# add replacement/saturation hydrogen or not
61AC_ARG_ENABLE([hydrogen],AS_HELP_STRING([--enable-hydrogen],[Adding saturation hydrogen (default is yes)]),
62 [enable_hydrogen=$enableval], [enable_hydrogen=yes])
63if test x"$enable_hydrogen" = xyes; then
64 AC_DEFINE(ADDHYDROGEN,1, ["Adding saturation hydrogen"])
65 AC_SUBST(ADDHYDROGEN)
66fi
67
68# add replacement/saturation hydrogen or not
69AC_ARG_ENABLE([ecut],AS_HELP_STRING([--enable-ecut],[Use ECut TestRunnerClient (default is yes)]),
70 [enable_ecut=$enableval], [enable_ecut=yes])
71if test x"$enable_ecut" = xyes; then
72 AC_DEFINE(HAVE_ECUT,1, ["Use ECut TestRunnerClient instead of our own."])
73 AC_SUBST(HAVE_ECUT)
74fi
75
76# Check for "extern inline", using a modified version
77# of the test for AC_C_INLINE from acspecific.mt
78AC_CACHE_CHECK([for extern inline], ac_cv_c_extern_inline,
79[ac_cv_c_extern_inline=no
80AC_TRY_COMPILE([extern $ac_cv_c_inline double foo(double x);
81extern $ac_cv_c_inline double foo(double x) { return x+1.0; };
82double foo (double x) { return x + 1.0; };],
83[ foo(1.0) ],
84[ac_cv_c_extern_inline="yes"])
85])
86
87if test "$ac_cv_c_inline" != no ; then
88 AC_DEFINE(HAVE_INLINE,1, ["May use inline routines"])
89 AC_SUBST(HAVE_INLINE)
90fi
91
92#AC_MSG_NOTICE(["CFLAGS: $CFLAGS, CXXFLAGS: $CXXFLAGS, LDFLAGS: $LDFLAGS, CC: $CC, CXX:, $CXX, MPICC: $MPICC, MPILIBS: $MPILIBS, LIBS: $LIBS"])
93
94# test suite
95AC_CONFIG_TESTDIR(tests)
96AC_CONFIG_FILES([
97 tests/atlocal
98 tests/Makefile])
99AC_CONFIG_FILES([
100 tests/Tesselations/Makefile
101 tests/Tesselations/defs])
102AC_CONFIG_FILES([tests/molecuilder], [chmod +x tests/molecuilder])
103AC_CONFIG_FILES([
104 doc/molecuilder.xml])
105AC_CONFIG_FILES([
106 Makefile
107 doc/Makefile
108 src/Makefile
109 src/Actions/Makefile
110 src/UIElements/Makefile
111 src/unittests/Makefile])
112AC_OUTPUT
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