easyblock = 'ConfigureMake' name = 'RELION' version = '1.3' homepage = 'http://www2.mrc-lmb.cam.ac.uk/relion/index.php/Main_Page' description = """RELION (for REgularised LIkelihood OptimisatioN, pronounce rely-on) is a stand-alone local_computer program that employs an empirical Bayesian approach to refinement of (multiple) 3D reconstructions or 2D class averages in electron cryo-microscopy (cryo-EM).""" toolchain = {'name': 'intel', 'version': '2015b'} source_urls = ['http://www2.mrc-lmb.cam.ac.uk/groups/scheres/18jun14'] sources = [SOURCELOWER_TAR_BZ2] patches = ['RELION-%(version)s_fltk-config.patch'] pythonversion = '-Python-2.7.8' builddependencies = [ ('xextproto', '7.3.0'), ] dependencies = [ ('FFTW', '3.3.4'), ('FLTK', '1.3.2'), ('libX11', '1.6.2', pythonversion), ('fontconfig', '2.11.1'), ('libXft', '2.3.2'), ('libXext', '1.3.2', pythonversion), ('libXinerama', '1.1.3'), ] # RELION expects FLTK to be in external/fltk-1.3.0 configopts = [ '--enable-mpi --enable-openmp && ln -s $EBROOTFLTK/include external/fltk-1.3.0'] buildopts = 'LIBS="-lfftw3_threads -lfftw3 -lm -lpthread -lfltk -lX11 -lXft -lfontconfig -lXext -lXinerama" ' # users expect the maingui binary to be called relion installopts = " && cp %(installdir)s/bin/relion_maingui %(installdir)s/bin/relion " moduleclass = 'bio'