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 BuildRoot:      %{tmpdir}/%{name}-%{version}-root-%(id -u -n)
  39
  40 %description
  41 Open Babel is a project designed to pick up where Babel left off, as a
  42 cross-platform program and library designed to interconvert between
  43 many file formats used in molecular modeling and computational
  44 chemistry.
  45
  46 %description -l pl.UTF-8
  47 Open Babel to projekt mający pozbierać to, co zostało po zaniechaniu
  48 projektu Babel, jako międzyplatformowy program i biblioteka służące do
  49 konwersji między wieloma formatami używanymi w modelowaniu cząsteczek
  50 i chemii obliczeniowej.
  51
  52 %package devel
  53 Summary:        Header files for OpenBabel
  54 Summary(pl.UTF-8):      Pliki nagłówkowe dla OpenBabel
  55 Group:          Development/Libraries
  56 Requires:       %{name} = %{version}-%{release}
  57 Requires:       libstdc++-devel
  58 Requires:       zlib-devel
  59 Obsoletes:      openbabel-static
  60
  61 %description devel
  62 Header files for OpenBabel.
  63
  64 %description devel -l pl.UTF-8
  65 Pliki nagłówkowe dla OpenBabel.
  66
  67 %package gui
  68 Summary:        OpenBabel GUI
  69 Summary(pl.UTF-8):      Graficzny interfejs użytkownika OpenBabel
  70 Group:          X11/Applications/Science
  71 Requires:       %{name} = %{version}-%{release}
  72
  73 %description gui
  74 Graphical User Interface for OpenBabel.
  75
  76 %description gui -l pl.UTF-8
  77 Graficzny interfejs użytkownika OpenBabel.
  78
  79 %package -n java-openbabel
  80 Summary:        Java binding for OpenBabel
  81 Summary(pl.UTF-8):      Wiązanie Javy do biblioteki OpenBabel
  82 Group:          Libraries/Java
  83
  84 %description -n java-openbabel
  85 Java binding for OpenBabel.
  86
  87 %description -n java-openbabel -l pl.UTF-8
  88 Wiązanie Javy do biblioteki OpenBabel.
  89
  90 %package -n perl-Chemistry-OpenBabel
  91 Summary:        Perl binding for OpenBabel
  92 Summary(pl.UTF-8):      Wiązanie Perla do biblioteki OpenBabel
  93 Group:          Development/Languages/Perl
  94 Requires:       %{name} = %{version}-%{release}
  95
  96 %description -n perl-Chemistry-OpenBabel
  97 Perl binding for OpenBabel.
  98
  99 %description -n perl-Chemistry-OpenBabel -l pl.UTF-8
 100 Wiązanie Perla do biblioteki OpenBabel.
 101
 102 %package -n python-openbabel
 103 Summary:        Python binding for OpenBabel
 104 Summary(pl.UTF-8):      Wiązanie Pythona do biblioteki OpenBabel
 105 Group:          Libraries/Python
 106 Requires:       %{name} = %{version}-%{release}
 107
 108 %description -n python-openbabel
 109 Python binding for OpenBabel.
 110
 111 %description -n python-openbabel -l pl.UTF-8
 112 Wiązanie Pythona do biblioteki OpenBabel.
 113
 114 %package -n ruby-openbabel
 115 Summary:        Ruby binding for OpenBabel
 116 Summary(pl.UTF-8):      Wiązanie języka Ruby do biblioteki OpenBabel
 117 Group:          Development/Languages
 118 Requires:       %{name} = %{version}-%{release}
 119
 120 %description -n ruby-openbabel
 121 Ruby binding for OpenBabel.
 122
 123 %description -n ruby-openbabel -l pl.UTF-8
 124 Wiązanie języka Ruby do biblioteki OpenBabel.
 125
 126 %prep
 127 %setup -q
 128 %patch0 -p1
 129 %patch1 -p1
 130 %patch2 -p1
 131 %patch3 -p0
 132
 133 %build
 134 %cmake . \
 135         %{?with_mono:-DCSHARP_BINDINGS=ON} \
 136         -DCSHARP_EXECUTABLE=/usr/bin/mcs \
 137         -DCMAKE_C_FLAGS_RELEASE="-DNDEBUG" \
 138         -DCMAKE_CXX_FLAGS_RELEASE="-DNDEBUG" \
 139         %{?with_java:-DJAVA_BINDINGS=ON} \
 140         -DOBPERL_INSTALLDIRS="vendor" \
 141         -DPERL_BINDINGS=ON \
 142         -DPYTHON_BINDINGS=ON \
 143         -DRUBY_BINDINGS=ON \
 144         -DOPENBABEL_USE_SYSTEM_INCHI=true \
 145         -DwxWidgets_CONFIG_EXECUTABLE=%{_bindir}/wx-gtk2-unicode-config \
 146         -DLIB_INSTALL_DIR=%{_libdir} \
 147         -DBIN_INSTALL_DIR=%{_bindir}
 148 %{__make}
 149
 150 %install
 151 rm -rf $RPM_BUILD_ROOT
 152
 153 %{__make} install \
 154         RUBYARCHDIR=$RPM_BUILD_ROOT%{ruby_vendorarchdir} \
 155         DESTDIR=$RPM_BUILD_ROOT
 156
 157 %{__mv} $RPM_BUILD_ROOT%{_libdir}/*.py $RPM_BUILD_ROOT%{py_sitedir}
 158
 159 %py_ocomp $RPM_BUILD_ROOT%{py_sitedir}
 160 %py_comp $RPM_BUILD_ROOT%{py_sitedir}
 161 %py_postclean
 162
 163 %if %{with java}
 164 install -d $RPM_BUILD_ROOT%{_javadir}
 165 %{__mv} $RPM_BUILD_ROOT%{_libdir}/*.jar $RPM_BUILD_ROOT%{_javadir}
 166 %endif
 167
 168 %clean
 169 rm -rf $RPM_BUILD_ROOT
 170
 171 %post   -p /sbin/ldconfig
 172 %postun -p /sbin/ldconfig
 173
 174 %files
 175 %defattr(644,root,root,755)
 176 %doc AUTHORS ChangeLog README THANKS doc/*.html
 177 %attr(755,root,root) %{_bindir}/babel
 178 %attr(755,root,root) %{_bindir}/obabel
 179 %attr(755,root,root) %{_bindir}/obchiral
 180 %attr(755,root,root) %{_bindir}/obconformer
 181 %attr(755,root,root) %{_bindir}/obenergy
 182 %attr(755,root,root) %{_bindir}/obfit
 183 %attr(755,root,root) %{_bindir}/obgen
 184 %attr(755,root,root) %{_bindir}/obgrep
 185 %attr(755,root,root) %{_bindir}/obminimize
 186 %attr(755,root,root) %{_bindir}/obprobe
 187 %attr(755,root,root) %{_bindir}/obprop
 188 %attr(755,root,root) %{_bindir}/obrms
 189 %attr(755,root,root) %{_bindir}/obrotamer
 190 %attr(755,root,root) %{_bindir}/obrotate
 191 %attr(755,root,root) %{_bindir}/obspectrophore
 192 %attr(755,root,root) %{_bindir}/roundtrip
 193 %attr(755,root,root) %{_libdir}/libopenbabel.so.*.*.*
 194 %attr(755,root,root) %ghost %{_libdir}/libopenbabel.so.4
 195 %dir %{_libdir}/openbabel
 196 %dir %{_libdir}/openbabel/%{version}
 197 %attr(755,root,root) %{_libdir}/openbabel/%{version}/*.so
 198 %{_datadir}/openbabel
 199 %{_mandir}/man1/babel.1*
 200 %{_mandir}/man1/obabel.1*
 201 %{_mandir}/man1/obchiral.1*
 202 %{_mandir}/man1/obconformer.1*
 203 %{_mandir}/man1/obenergy.1*
 204 %{_mandir}/man1/obfit.1*
 205 %{_mandir}/man1/obgen.1*
 206 %{_mandir}/man1/obgrep.1*
 207 %{_mandir}/man1/obminimize.1*
 208 %{_mandir}/man1/obprobe.1*
 209 %{_mandir}/man1/obprop.1*
 210 %{_mandir}/man1/obrotamer.1*
 211 %{_mandir}/man1/obrotate.1*
 212 %{_mandir}/man1/obspectrophore.1*
 213 %{_mandir}/man1/roundtrip.1*
 214
 215 %files devel
 216 %defattr(644,root,root,755)
 217 %attr(755,root,root) %{_libdir}/libopenbabel.so
 218 %{_includedir}/openbabel-2.0
 219 %{_pkgconfigdir}/openbabel-2.0.pc
 220 %{_libdir}/cmake/openbabel2
 221
 222 %files gui
 223 %defattr(644,root,root,755)
 224 %attr(755,root,root) %{_bindir}/obgui
 225 %{_mandir}/man1/obgui.1*
 226
 227 %if %{with java}
 228 %files -n java-openbabel
 229 %defattr(644,root,root,755)
 230 %attr(755,root,root) %{_libdir}/libopenbabel_java.so
 231 %{_javadir}/openbabel.jar
 232 %endif
 233
 234 %files -n perl-Chemistry-OpenBabel
 235 %defattr(644,root,root,755)
 236 %{perl_vendorarch}/Chemistry/OpenBabel.pm
 237 %dir %{perl_vendorarch}/auto/Chemistry/OpenBabel
 238 %{perl_vendorarch}/auto/Chemistry/OpenBabel/OpenBabel.bs
 239 %attr(755,root,root) %{perl_vendorarch}/auto/Chemistry/OpenBabel/OpenBabel.so
 240
 241 %files -n python-openbabel
 242 %defattr(644,root,root,755)
 243 %attr(755,root,root) %{py_sitedir}/_openbabel.so
 244 %{py_sitedir}/openbabel.py[co]
 245 %{py_sitedir}/pybel.py[co]
 246 %{py_sitedir}/openbabel-1.7-py*.egg-info
 247
 248 %files -n ruby-openbabel
 249 %defattr(644,root,root,755)
 250 %attr(755,root,root) %{ruby_vendorarchdir}/openbabel.so