Merge branch 'it4i-salomon'

f/FFTW/FFTW-3.3.8-gompi-2019b.eb

@@ -0,0 +1,26 @@
+# IT4Innovations 2020
+
+name = 'FFTW'
+version = '3.3.8'
+
+homepage = 'http://www.fftw.org'
+description = """FFTW is a C subroutine library for local_computing the discrete Fourier transform (DFT)
+ in one or more dimensions, of arbitrary input size, and of both real and local_complex data."""
+
+toolchain = {'name': 'gompi', 'version': '2019b'}
+toolchainopts = {'pic': True}
+
+source_urls = [homepage]
+sources = [SOURCELOWER_TAR_GZ]
+
+# no quad precision, requires GCC v4.6 or higher
+# see also
+# http://www.fftw.org/doc/Extended-and-quadruple-precision-in-Fortran.html
+with_quad_prec = False
+
+# local_compilation fails when configuring with --enable-avx-128-fma, Intel local_compilers do not support FMA4 instructions
+use_fma4 = False
+
+runtest = 'check'
+
+moduleclass = 'numlib'

r/RELION/RELION-3.0.8-gompi-2019b.eb

@@ -0,0 +1,31 @@
+# IT4Innovations 2020
+
+easyblock = 'CMakeMake'
+
+name = 'RELION'
+version = '3.0.8'
+
+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': 'gompi', 'version': '2019b'}
+toolchainopts = {'opt': True}
+
+source_urls = ['https://github.com/3dem/relion/archive']
+sources = ['%(version)s.tar.gz']
+
+builddependencies = [
+    ('CMake', '3.16.2', '', True),
+]
+
+dependencies = [
+    ('X11', '20190717', '', True),
+    ('libpng', '1.6.37', '', True),
+    ('FFTW', '3.3.8'),
+]
+
+separate_build_dir = True
+
+moduleclass = 'bio'