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 %define snap    2d45874
   9 Summary:        A cross-platform chemistry program and library designed to convert file formats
  10 Summary(pl.UTF-8):      Międzyplatformowy program chemiczny i biblioteka do konwersji formatów plików
  11 Name:           openbabel
  12 Version:        2.3.90
  13 Release:        3
  14 License:        GPL v2
  15 Group:          Libraries
  16 Source0:        https://github.com/openbabel/openbabel/archive/%{snap}/%{name}-%{version}-%{snap}.tar.gz
  17 # Source0-md5:  32f083d63a0a17f1871a831edad3a912
  18 Patch0:         %{name}-prefix.patch
  19 Patch1:         perl-x32.patch
  20 Patch2:         perl-install.patch
  21 Patch3:         ruby-install.patch
  22 Patch4:         swig-java.patch
  23 Patch5:         plugindir.patch
  24 URL:            http://openbabel.sourceforge.net/
  25 BuildRequires:  cairo-devel
  26 BuildRequires:  cmake >= 2.6.0
  27 BuildRequires:  eigen3 >= 3
  28 BuildRequires:  inchi-devel >= 1.0.3
  29 %{?with_java:BuildRequires:     jdk}
  30 BuildRequires:  libstdc++-devel
  31 BuildRequires:  libxml2-devel >= 2.6.5
  32 %{?with_mono:BuildRequires:     mono-csharp}
  33 BuildRequires:  perl-devel
  34 BuildRequires:  rpm-perlprov
  35 BuildRequires:  rpm-pythonprov
  36 BuildRequires:  rpmbuild(macros) >= 1.577
  37 BuildRequires:  ruby-devel
  38 BuildRequires:  swig >= 2.0
  39 BuildRequires:  wxGTK2-unicode-devel
  40 BuildRequires:  zlib-devel
  41 Requires:       inchi-libs >= 1.0.3
  42 BuildRoot:      %{tmpdir}/%{name}-%{version}-root-%(id -u -n)
  43
  44 %description
  45 Open Babel is a project designed to pick up where Babel left off, as a
  46 cross-platform program and library designed to interconvert between
  47 many file formats used in molecular modeling and computational
  48 chemistry.
  49
  50 %description -l pl.UTF-8
  51 Open Babel to projekt mający pozbierać to, co zostało po zaniechaniu
  52 projektu Babel, jako międzyplatformowy program i biblioteka służące do
  53 konwersji między wieloma formatami używanymi w modelowaniu cząsteczek
  54 i chemii obliczeniowej.
  55
  56 %package devel
  57 Summary:        Header files for OpenBabel
  58 Summary(pl.UTF-8):      Pliki nagłówkowe dla OpenBabel
  59 Group:          Development/Libraries
  60 Requires:       %{name} = %{version}-%{release}
  61 Requires:       libstdc++-devel
  62 Requires:       zlib-devel
  63 Obsoletes:      openbabel-static
  64
  65 %description devel
  66 Header files for OpenBabel.
  67
  68 %description devel -l pl.UTF-8
  69 Pliki nagłówkowe dla OpenBabel.
  70
  71 %package gui
  72 Summary:        OpenBabel GUI
  73 Summary(pl.UTF-8):      Graficzny interfejs użytkownika OpenBabel
  74 Group:          X11/Applications/Science
  75 Requires:       %{name} = %{version}-%{release}
  76
  77 %description gui
  78 Graphical User Interface for OpenBabel.
  79
  80 %description gui -l pl.UTF-8
  81 Graficzny interfejs użytkownika OpenBabel.
  82
  83 %package -n java-openbabel
  84 Summary:        Java binding for OpenBabel
  85 Summary(pl.UTF-8):      Wiązanie Javy do biblioteki OpenBabel
  86 Group:          Libraries/Java
  87
  88 %description -n java-openbabel
  89 Java binding for OpenBabel.
  90
  91 %description -n java-openbabel -l pl.UTF-8
  92 Wiązanie Javy do biblioteki OpenBabel.
  93
  94 %package -n perl-Chemistry-OpenBabel
  95 Summary:        Perl binding for OpenBabel
  96 Summary(pl.UTF-8):      Wiązanie Perla do biblioteki OpenBabel
  97 Group:          Development/Languages/Perl
  98 Requires:       %{name} = %{version}-%{release}
  99
 100 %description -n perl-Chemistry-OpenBabel
 101 Perl binding for OpenBabel.
 102
 103 %description -n perl-Chemistry-OpenBabel -l pl.UTF-8
 104 Wiązanie Perla do biblioteki OpenBabel.
 105
 106 %package -n python-openbabel
 107 Summary:        Python binding for OpenBabel
 108 Summary(pl.UTF-8):      Wiązanie Pythona do biblioteki OpenBabel
 109 Group:          Libraries/Python
 110 Requires:       %{name} = %{version}-%{release}
 111
 112 %description -n python-openbabel
 113 Python binding for OpenBabel.
 114
 115 %description -n python-openbabel -l pl.UTF-8
 116 Wiązanie Pythona do biblioteki OpenBabel.
 117
 118 %package -n ruby-openbabel
 119 Summary:        Ruby binding for OpenBabel
 120 Summary(pl.UTF-8):      Wiązanie języka Ruby do biblioteki OpenBabel
 121 Group:          Development/Languages
 122 Requires:       %{name} = %{version}-%{release}
 123
 124 %description -n ruby-openbabel
 125 Ruby binding for OpenBabel.
 126
 127 %description -n ruby-openbabel -l pl.UTF-8
 128 Wiązanie języka Ruby do biblioteki OpenBabel.
 129
 130 %prep
 131 %setup -q -c
 132 %{__mv} %{name}-%{snap}*/* ./
 133 %patch0 -p1
 134 %patch1 -p1
 135 %patch2 -p1
 136 %patch3 -p1
 137 %patch4 -p1
 138 %patch5 -p1
 139
 140 %build
 141 %cmake . \
 142         -DBIN_INSTALL_DIR=%{_bindir} \
 143         -DLIB_INSTALL_DIR=%{_lib} \
 144         %{?with_mono:-DCSHARP_BINDINGS=ON} \
 145         -DCSHARP_EXECUTABLE=/usr/bin/mcs \
 146         -DCMAKE_C_FLAGS_RELEASE="-DNDEBUG" \
 147         -DCMAKE_CXX_FLAGS_RELEASE="-DNDEBUG" \
 148         %{?with_java:-DJAVA_BINDINGS=ON} \
 149         -DOBPERL_INSTALLDIRS="vendor" \
 150         -DPERL_BINDINGS=ON \
 151         -DPYTHON_BINDINGS=ON \
 152         -DRUBY_BINDINGS=ON \
 153         -DRUN_SWIG=ON \
 154         -DOPENBABEL_USE_SYSTEM_INCHI=ON \
 155         -DwxWidgets_CONFIG_EXECUTABLE=%{_bindir}/wx-gtk2-unicode-config \
 156         -DPERLLIB_INSTALL_DIR=%{perl_vendorarch} \
 157         -DRUBYLIB_INSTALL_DIR=%{ruby_vendorarchdir}
 158 %{__make}
 159
 160 %install
 161 rm -rf $RPM_BUILD_ROOT
 162 install -d $RPM_BUILD_ROOT%{py_sitedir}
 163
 164 %{__make} install \
 165         RUBYARCHDIR=$RPM_BUILD_ROOT%{ruby_vendorarchdir} \
 166         DESTDIR=$RPM_BUILD_ROOT
 167
 168 %py_ocomp $RPM_BUILD_ROOT%{py_sitedir}
 169 %py_comp $RPM_BUILD_ROOT%{py_sitedir}
 170 %py_postclean
 171
 172 %if %{with java}
 173 install -d $RPM_BUILD_ROOT%{_javadir}
 174 %{__mv} $RPM_BUILD_ROOT%{_libdir}/*.jar $RPM_BUILD_ROOT%{_javadir}
 175 %endif
 176
 177 %clean
 178 rm -rf $RPM_BUILD_ROOT
 179
 180 %post   -p /sbin/ldconfig
 181 %postun -p /sbin/ldconfig
 182
 183 %files
 184 %defattr(644,root,root,755)
 185 %doc AUTHORS README.md THANKS doc/*.html
 186 %attr(755,root,root) %{_bindir}/babel
 187 %attr(755,root,root) %{_bindir}/obabel
 188 %attr(755,root,root) %{_bindir}/obchiral
 189 %attr(755,root,root) %{_bindir}/obconformer
 190 %attr(755,root,root) %{_bindir}/obdistgen
 191 %attr(755,root,root) %{_bindir}/obenergy
 192 %attr(755,root,root) %{_bindir}/obfit
 193 %attr(755,root,root) %{_bindir}/obgen
 194 %attr(755,root,root) %{_bindir}/obgrep
 195 %attr(755,root,root) %{_bindir}/obminimize
 196 %attr(755,root,root) %{_bindir}/obprobe
 197 %attr(755,root,root) %{_bindir}/obprop
 198 %attr(755,root,root) %{_bindir}/obrms
 199 %attr(755,root,root) %{_bindir}/obrotamer
 200 %attr(755,root,root) %{_bindir}/obrotate
 201 %attr(755,root,root) %{_bindir}/obspectrophore
 202 %attr(755,root,root) %{_bindir}/obsym
 203 %attr(755,root,root) %{_bindir}/obtautomer
 204 %attr(755,root,root) %{_bindir}/obthermo
 205 %attr(755,root,root) %{_bindir}/roundtrip
 206 %attr(755,root,root) %{_libdir}/libopenbabel.so.*.*.*
 207 %attr(755,root,root) %ghost %{_libdir}/libopenbabel.so.4
 208 %dir %{_libdir}/openbabel
 209 %dir %{_libdir}/openbabel/%{version}
 210 %attr(755,root,root) %{_libdir}/openbabel/%{version}/*.so
 211 %{_datadir}/openbabel
 212 %{_mandir}/man1/babel.1*
 213 %{_mandir}/man1/obabel.1*
 214 %{_mandir}/man1/obchiral.1*
 215 %{_mandir}/man1/obconformer.1*
 216 %{_mandir}/man1/obenergy.1*
 217 %{_mandir}/man1/obfit.1*
 218 %{_mandir}/man1/obgen.1*
 219 %{_mandir}/man1/obgrep.1*
 220 %{_mandir}/man1/obminimize.1*
 221 %{_mandir}/man1/obprobe.1*
 222 %{_mandir}/man1/obprop.1*
 223 %{_mandir}/man1/obrotamer.1*
 224 %{_mandir}/man1/obrotate.1*
 225 %{_mandir}/man1/obspectrophore.1*
 226 %{_mandir}/man1/roundtrip.1*
 227
 228 %files devel
 229 %defattr(644,root,root,755)
 230 %attr(755,root,root) %{_libdir}/libopenbabel.so
 231 %{_includedir}/openbabel-2.0
 232 %{_pkgconfigdir}/openbabel-2.0.pc
 233 %{_libdir}/cmake/openbabel2
 234
 235 %files gui
 236 %defattr(644,root,root,755)
 237 %attr(755,root,root) %{_bindir}/obgui
 238 %{_mandir}/man1/obgui.1*
 239
 240 %if %{with java}
 241 %files -n java-openbabel
 242 %defattr(644,root,root,755)
 243 %attr(755,root,root) %{_libdir}/libopenbabel_java.so
 244 %{_javadir}/openbabel.jar
 245 %endif
 246
 247 %files -n perl-Chemistry-OpenBabel
 248 %defattr(644,root,root,755)
 249 %{perl_vendorarch}/Chemistry/OpenBabel.pm
 250 %dir %{perl_vendorarch}/auto/Chemistry/OpenBabel
 251 %attr(755,root,root) %{perl_vendorarch}/auto/Chemistry/OpenBabel/OpenBabel.so
 252
 253 %files -n python-openbabel
 254 %defattr(644,root,root,755)
 255 %attr(755,root,root) %{py_sitedir}/_openbabel.so
 256 %{py_sitedir}/openbabel.py[co]
 257 %{py_sitedir}/pybel.py[co]
 258 #%{py_sitedir}/openbabel-1.7-py*.egg-info
 259
 260 %files -n ruby-openbabel
 261 %defattr(644,root,root,755)
 262 %attr(755,root,root) %{ruby_vendorarchdir}/openbabel.so