openbabel.spec

   1 # TODO:
   2 # - install+package csharp bindings
   3 #
   4 # Conditional build:
   5 %bcond_without  java    # Java/JNI bindings
   6 %bcond_with     mono    # .NET/C# bindings
   7 #
   8 Summary:        A cross-platform chemistry program and library designed to convert file formats
   9 Summary(pl.UTF-8):      Międzyplatformowy program chemiczny i biblioteka do konwersji formatów plików
  10 Name:           openbabel
  11 Version:        2.3.2
  12 Release:        1
  13 License:        GPL v2
  14 Group:          Libraries
  15 Source0:        http://downloads.sourceforge.net/openbabel/%{name}-%{version}.tar.gz
  16 # Source0-md5:  9b0007560d9d838b40ab4ad06daf5610
  17 Patch0:         %{name}-prefix.patch
  18 Patch1:         ruby-gcc-no-option.patch
  19 Patch2:         cmake-fix.patch
  20 Patch3:         python-build.patch
  21 URL:            http://openbabel.sourceforge.net/
  22 BuildRequires:  cairo-devel
  23 BuildRequires:  cmake >= 2.6.0
  24 BuildRequires:  eigen3 >= 3
  25 BuildRequires:  inchi-devel >= 1.0.3
  26 %{?with_java:BuildRequires:     jdk}
  27 BuildRequires:  libstdc++-devel
  28 BuildRequires:  libxml2-devel >= 2.6.5
  29 %{?with_mono:BuildRequires:     mono-csharp}
  30 BuildRequires:  perl-devel
  31 BuildRequires:  rpm-perlprov
  32 BuildRequires:  rpm-pythonprov
  33 BuildRequires:  rpmbuild(macros) >= 1.577
  34 BuildRequires:  ruby-devel
  35 BuildRequires:  swig >= 2.0
  36 BuildRequires:  wxGTK2-devel
  37 BuildRequires:  zlib-devel
  38 Requires:       inchi-libs >= 1.0.3
  39 BuildRoot:      %{tmpdir}/%{name}-%{version}-root-%(id -u -n)
  40
  41 %description
  42 Open Babel is a project designed to pick up where Babel left off, as a
  43 cross-platform program and library designed to interconvert between
  44 many file formats used in molecular modeling and computational
  45 chemistry.
  46
  47 %description -l pl.UTF-8
  48 Open Babel to projekt mający pozbierać to, co zostało po zaniechaniu
  49 projektu Babel, jako międzyplatformowy program i biblioteka służące do
  50 konwersji między wieloma formatami używanymi w modelowaniu cząsteczek
  51 i chemii obliczeniowej.
  52
  53 %package devel
  54 Summary:        Header files for OpenBabel
  55 Summary(pl.UTF-8):      Pliki nagłówkowe dla OpenBabel
  56 Group:          Development/Libraries
  57 Requires:       %{name} = %{version}-%{release}
  58 Requires:       libstdc++-devel
  59 Requires:       zlib-devel
  60 Obsoletes:      openbabel-static
  61
  62 %description devel
  63 Header files for OpenBabel.
  64
  65 %description devel -l pl.UTF-8
  66 Pliki nagłówkowe dla OpenBabel.
  67
  68 %package gui
  69 Summary:        OpenBabel GUI
  70 Summary(pl.UTF-8):      Graficzny interfejs użytkownika OpenBabel
  71 Group:          X11/Applications/Science
  72 Requires:       %{name} = %{version}-%{release}
  73
  74 %description gui
  75 Graphical User Interface for OpenBabel.
  76
  77 %description gui -l pl.UTF-8
  78 Graficzny interfejs użytkownika OpenBabel.
  79
  80 %package -n java-openbabel
  81 Summary:        Java binding for OpenBabel
  82 Summary(pl.UTF-8):      Wiązanie Javy do biblioteki OpenBabel
  83 Group:          Libraries/Java
  84
  85 %description -n java-openbabel
  86 Java binding for OpenBabel.
  87
  88 %description -n java-openbabel -l pl.UTF-8
  89 Wiązanie Javy do biblioteki OpenBabel.
  90
  91 %package -n perl-Chemistry-OpenBabel
  92 Summary:        Perl binding for OpenBabel
  93 Summary(pl.UTF-8):      Wiązanie Perla do biblioteki OpenBabel
  94 Group:          Development/Languages/Perl
  95 Requires:       %{name} = %{version}-%{release}
  96
  97 %description -n perl-Chemistry-OpenBabel
  98 Perl binding for OpenBabel.
  99
 100 %description -n perl-Chemistry-OpenBabel -l pl.UTF-8
 101 Wiązanie Perla do biblioteki OpenBabel.
 102
 103 %package -n python-openbabel
 104 Summary:        Python binding for OpenBabel
 105 Summary(pl.UTF-8):      Wiązanie Pythona do biblioteki OpenBabel
 106 Group:          Libraries/Python
 107 Requires:       %{name} = %{version}-%{release}
 108
 109 %description -n python-openbabel
 110 Python binding for OpenBabel.
 111
 112 %description -n python-openbabel -l pl.UTF-8
 113 Wiązanie Pythona do biblioteki OpenBabel.
 114
 115 %package -n ruby-openbabel
 116 Summary:        Ruby binding for OpenBabel
 117 Summary(pl.UTF-8):      Wiązanie języka Ruby do biblioteki OpenBabel
 118 Group:          Development/Languages
 119 Requires:       %{name} = %{version}-%{release}
 120
 121 %description -n ruby-openbabel
 122 Ruby binding for OpenBabel.
 123
 124 %description -n ruby-openbabel -l pl.UTF-8
 125 Wiązanie języka Ruby do biblioteki OpenBabel.
 126
 127 %prep
 128 %setup -q
 129 %patch0 -p1
 130 %patch1 -p1
 131 %patch2 -p1
 132 %patch3 -p0
 133
 134 %build
 135 %cmake . \
 136         -DBIN_INSTALL_DIR=%{_bindir} \
 137         -DLIB_INSTALL_DIR=%{_lib} \
 138         %{?with_mono:-DCSHARP_BINDINGS=ON} \
 139         -DCSHARP_EXECUTABLE=/usr/bin/mcs \
 140         -DCMAKE_C_FLAGS_RELEASE="-DNDEBUG" \
 141         -DCMAKE_CXX_FLAGS_RELEASE="-DNDEBUG" \
 142         %{?with_java:-DJAVA_BINDINGS=ON} \
 143         -DOBPERL_INSTALLDIRS="vendor" \
 144         -DPERL_BINDINGS=ON \
 145         -DPYTHON_BINDINGS=ON \
 146         -DRUBY_BINDINGS=ON \
 147         -DOPENBABEL_USE_SYSTEM_INCHI=ON \
 148         -DwxWidgets_CONFIG_EXECUTABLE=%{_bindir}/wx-gtk2-unicode-config
 149 %{__make}
 150
 151 %install
 152 rm -rf $RPM_BUILD_ROOT
 153
 154 %{__make} install \
 155         RUBYARCHDIR=$RPM_BUILD_ROOT%{ruby_vendorarchdir} \
 156         DESTDIR=$RPM_BUILD_ROOT
 157
 158 %{__mv} $RPM_BUILD_ROOT%{_libdir}/*.py $RPM_BUILD_ROOT%{py_sitedir}
 159
 160 %py_ocomp $RPM_BUILD_ROOT%{py_sitedir}
 161 %py_comp $RPM_BUILD_ROOT%{py_sitedir}
 162 %py_postclean
 163
 164 %if %{with java}
 165 install -d $RPM_BUILD_ROOT%{_javadir}
 166 %{__mv} $RPM_BUILD_ROOT%{_libdir}/*.jar $RPM_BUILD_ROOT%{_javadir}
 167 %endif
 168
 169 %clean
 170 rm -rf $RPM_BUILD_ROOT
 171
 172 %post   -p /sbin/ldconfig
 173 %postun -p /sbin/ldconfig
 174
 175 %files
 176 %defattr(644,root,root,755)
 177 %doc AUTHORS ChangeLog README THANKS doc/*.html
 178 %attr(755,root,root) %{_bindir}/babel
 179 %attr(755,root,root) %{_bindir}/obabel
 180 %attr(755,root,root) %{_bindir}/obchiral
 181 %attr(755,root,root) %{_bindir}/obconformer
 182 %attr(755,root,root) %{_bindir}/obenergy
 183 %attr(755,root,root) %{_bindir}/obfit
 184 %attr(755,root,root) %{_bindir}/obgen
 185 %attr(755,root,root) %{_bindir}/obgrep
 186 %attr(755,root,root) %{_bindir}/obminimize
 187 %attr(755,root,root) %{_bindir}/obprobe
 188 %attr(755,root,root) %{_bindir}/obprop
 189 %attr(755,root,root) %{_bindir}/obrms
 190 %attr(755,root,root) %{_bindir}/obrotamer
 191 %attr(755,root,root) %{_bindir}/obrotate
 192 %attr(755,root,root) %{_bindir}/obspectrophore
 193 %attr(755,root,root) %{_bindir}/roundtrip
 194 %attr(755,root,root) %{_libdir}/libopenbabel.so.*.*.*
 195 %attr(755,root,root) %ghost %{_libdir}/libopenbabel.so.4
 196 %dir %{_libdir}/openbabel
 197 %dir %{_libdir}/openbabel/%{version}
 198 %attr(755,root,root) %{_libdir}/openbabel/%{version}/*.so
 199 %{_datadir}/openbabel
 200 %{_mandir}/man1/babel.1*
 201 %{_mandir}/man1/obabel.1*
 202 %{_mandir}/man1/obchiral.1*
 203 %{_mandir}/man1/obconformer.1*
 204 %{_mandir}/man1/obenergy.1*
 205 %{_mandir}/man1/obfit.1*
 206 %{_mandir}/man1/obgen.1*
 207 %{_mandir}/man1/obgrep.1*
 208 %{_mandir}/man1/obminimize.1*
 209 %{_mandir}/man1/obprobe.1*
 210 %{_mandir}/man1/obprop.1*
 211 %{_mandir}/man1/obrotamer.1*
 212 %{_mandir}/man1/obrotate.1*
 213 %{_mandir}/man1/obspectrophore.1*
 214 %{_mandir}/man1/roundtrip.1*
 215
 216 %files devel
 217 %defattr(644,root,root,755)
 218 %attr(755,root,root) %{_libdir}/libopenbabel.so
 219 %{_includedir}/openbabel-2.0
 220 %{_pkgconfigdir}/openbabel-2.0.pc
 221 %{_libdir}/cmake/openbabel2
 222
 223 %files gui
 224 %defattr(644,root,root,755)
 225 %attr(755,root,root) %{_bindir}/obgui
 226 %{_mandir}/man1/obgui.1*
 227
 228 %if %{with java}
 229 %files -n java-openbabel
 230 %defattr(644,root,root,755)
 231 %attr(755,root,root) %{_libdir}/libopenbabel_java.so
 232 %{_javadir}/openbabel.jar
 233 %endif
 234
 235 %files -n perl-Chemistry-OpenBabel
 236 %defattr(644,root,root,755)
 237 %{perl_vendorarch}/Chemistry/OpenBabel.pm
 238 %dir %{perl_vendorarch}/auto/Chemistry/OpenBabel
 239 %{perl_vendorarch}/auto/Chemistry/OpenBabel/OpenBabel.bs
 240 %attr(755,root,root) %{perl_vendorarch}/auto/Chemistry/OpenBabel/OpenBabel.so
 241
 242 %files -n python-openbabel
 243 %defattr(644,root,root,755)
 244 %attr(755,root,root) %{py_sitedir}/_openbabel.so
 245 %{py_sitedir}/openbabel.py[co]
 246 %{py_sitedir}/pybel.py[co]
 247 %{py_sitedir}/openbabel-1.7-py*.egg-info
 248
 249 %files -n ruby-openbabel
 250 %defattr(644,root,root,755)
 251 %attr(755,root,root) %{ruby_vendorarchdir}/openbabel.so