new file: a/ASE/ASE-3.15.0-Py-3.6.eb

new file: b/BoltzTraP2/BoltzTraP2-18.1.1-Py-3.6.eb new file: c/click/click-6.7-Py-3.6.eb new file: c/cycler/cycler-0.10.0-Py-3.6.eb new file: f/Flask/Flask-0.12.2-Py-3.6.eb new file: i/icc/icc-2017.4.196-GCC-6.3.0-2.27.eb new file: i/iccifort/iccifort-2017.4.196-GCC-6.3.0-2.27.eb new file: i/ifort/ifort-2017.4.196-GCC-6.3.0-2.27.eb modified: i/iimpi/iimpi-2017b.eb new file: i/impi/impi-2017.3.196-iccifort-2017.4.196-GCC-6.3.0-2.27.eb modified: i/intel/intel-2017b.eb new file: i/itsdangerous/itsdangerous-0.24-Py-3.6.eb new file: j/Jinja2/Jinja2-2.10-Py-3.6.eb new file: m/MarkupSafe/MarkupSafe-1.0-Py-3.6.eb new file: m/matplotlib/matplotlib-2.1.1-Py-3.6.eb new file: n/numpy/numpy-1.13.3-Py-3.6.eb new file: p/Py/Py-2.7.eb new file: p/Py/Py-3.6.eb new file: p/Python/.Python-3.6.4-base.eb.swp new file: p/Python/Python-2.7.14-base.eb new file: p/Python/Python-3.6.4-base.eb new file: p/pyparsing/pyparsing-2.2.0-Py-3.6.eb new file: p/python-dateutil/python-dateutil-2.6.1-Py-3.6.eb new file: p/pytz/pytz-2017.3-Py-3.6.eb new file: s/scipy/scipy-1.0.0-Py-3.6.eb new file: s/six/six-1.11.0-Py-2.7.eb new file: s/six/six-1.11.0-Py-3.6.eb new file: s/spglib-python/spglib-python-1.10.2.4-Py-3.6.eb new file: w/Werkzeug/Werkzeug-0.14.1-Py-3.6.eb deleted: a/ASE/ASE-3.15.0-Python-3.6.2-base.eb deleted: i/impi/impi-2017.3.196-iccifort-2017.4.196-GCC-6.4.0-2.28.eb deleted: m/matplotlib/matplotlib-2.1.1-Python-3.6.2-base.eb deleted: n/numpy/numpy-1.13.3-Python-3.6.2-base.eb deleted: p/pyparsing/pyparsing-2.2.0-Python-3.6.2-base.eb deleted: p/python-dateutil/python-dateutil-2.6.1-Python-3.6.2-base.eb deleted: s/scipy/scipy-1.0.0-Python-3.6.2-base.eb deleted: s/six/six-1.11.0-Python-3.6.2-base.eb

new file: a/ASE/ASE-3.15.0-Py-3.6.eb
new file: b/BoltzTraP2/BoltzTraP2-18.1.1-Py-3.6.eb new file: c/click/click-6.7-Py-3.6.eb new file: c/cycler/cycler-0.10.0-Py-3.6.eb new file: f/Flask/Flask-0.12.2-Py-3.6.eb new file: i/icc/icc-2017.4.196-GCC-6.3.0-2.27.eb new file: i/iccifort/iccifort-2017.4.196-GCC-6.3.0-2.27.eb new file: i/ifort/ifort-2017.4.196-GCC-6.3.0-2.27.eb modified: i/iimpi/iimpi-2017b.eb new file: i/impi/impi-2017.3.196-iccifort-2017.4.196-GCC-6.3.0-2.27.eb modified: i/intel/intel-2017b.eb new file: i/itsdangerous/itsdangerous-0.24-Py-3.6.eb new file: j/Jinja2/Jinja2-2.10-Py-3.6.eb new file: m/MarkupSafe/MarkupSafe-1.0-Py-3.6.eb new file: m/matplotlib/matplotlib-2.1.1-Py-3.6.eb new file: n/numpy/numpy-1.13.3-Py-3.6.eb new file: p/Py/Py-2.7.eb new file: p/Py/Py-3.6.eb new file: p/Python/.Python-3.6.4-base.eb.swp new file: p/Python/Python-2.7.14-base.eb new file: p/Python/Python-3.6.4-base.eb new file: p/pyparsing/pyparsing-2.2.0-Py-3.6.eb new file: p/python-dateutil/python-dateutil-2.6.1-Py-3.6.eb new file: p/pytz/pytz-2017.3-Py-3.6.eb new file: s/scipy/scipy-1.0.0-Py-3.6.eb new file: s/six/six-1.11.0-Py-2.7.eb new file: s/six/six-1.11.0-Py-3.6.eb new file: s/spglib-python/spglib-python-1.10.2.4-Py-3.6.eb new file: w/Werkzeug/Werkzeug-0.14.1-Py-3.6.eb deleted: a/ASE/ASE-3.15.0-Python-3.6.2-base.eb deleted: i/impi/impi-2017.3.196-iccifort-2017.4.196-GCC-6.4.0-2.28.eb deleted: m/matplotlib/matplotlib-2.1.1-Python-3.6.2-base.eb deleted: n/numpy/numpy-1.13.3-Python-3.6.2-base.eb deleted: p/pyparsing/pyparsing-2.2.0-Python-3.6.2-base.eb deleted: p/python-dateutil/python-dateutil-2.6.1-Python-3.6.2-base.eb deleted: s/scipy/scipy-1.0.0-Python-3.6.2-base.eb deleted: s/six/six-1.11.0-Python-3.6.2-base.eb
c2eeebc0 · Lukáš Krupčík · e99e98f1 · c2eeebc0 · c2eeebc0 · c2eeebc0
Commit c2eeebc0 authored Jan 05, 2018 by Lukáš Krupčík
29 changed files
--- a/a/ASE/ASE-3.15.0-Python-3.6.2-base.eb
+++ b/a/ASE/ASE-3.15.0-Python-3.6.2-base.eb
@@ -4,28 +4,27 @@ easyblock = 'PythonPackage'

 name = 'ASE'
 version = '3.15.0'
-versionsuffix = '-Python-%(pyver)s-base'

 homepage = 'https://wiki.fysik.dtu.dk/ase/'
 description = """ASE is a python package providing an open source Atomic Simulation Environment
 in the Python scripting language."""

-toolchain = {'name': 'dummy', 'version': ''}
+toolchain = {'name': 'Py', 'version': '3.6'}

 source_urls = [PYPI_LOWER_SOURCE]
 sources = [SOURCELOWER_TAR_GZ]
 checksums = ['5e22d961b1311ef4ba2d83527f7cc7448abac8cf9bddd1593bee548459263fe8']

 dependencies = [
-    ('Python', '2.6.2', '-base'),
-    ('numpy', '1.13.3', versionsuffix),
-    ('scipy', '1.0.0', versionsuffix),
-    ('matplotlib', '2.1.1', versionsuffix),
+    ('numpy', '1.13.3'),
+    ('scipy', '1.0.0'),
+    ('matplotlib', '2.1.1'),
+    ('click', '6.7'),
 ]

 sanity_check_paths = {
    'files': ['bin/ase-build', 'bin/ase-db', 'bin/ase-gui', 'bin/ase-info', 'bin/ase-run'],
-    'dirs': ['lib/python%(pyshortver)s/site-packages'],
+    'dirs': ['lib/python3.6/site-packages'],
 }

-moduleclass = 'chem'
+moduleclass = 'python'
--- a/b/BoltzTraP2/BoltzTraP2-18.1.1-Py-3.6.eb
+++ b/b/BoltzTraP2/BoltzTraP2-18.1.1-Py-3.6.eb
+# IT4Innovations 2018
+
+easyblock = "PythonPackage"
+name = 'BoltzTraP2'
+version = '18.1.1'
+
+homepage = 'https://www.imc.tuwien.ac.at/index.php?id=21094'
+description = """BoltzTraP2 is a modern implementation of the smoothed Fourier 
+  interpolation algorithm for electronic bands that formed the base of the original 
+  and widely used BoltzTraP code."""
+
+toolchain = {'name': 'Py', 'version': '3.6'}
+
+source_urls = ['https://pypi.python.org/packages/1f/03/9a93c7cbaead26dd82c3598696d57a590bc435e619e364fa71eaa0437aa5']
+sources = ['BoltzTraP2-%(version)s.tar.gz']
+
+dependencies = [
+    ('numpy', '1.13.3'),
+    ('scipy', '1.0.0'),
+    ('matplotlib', '2.1.1'),
+    ('spglib-python', '1.10.2.4'), 
+    ('ASE', '3.15.0'),
+]
+
+builddependencies = [
+    ('GCC', '6.3.0-2.27', '', True),
+    ('CMake', '3.9.1', '', True),
+]
+
+options = {'modulename': 'BoltzTraP2'}
+
+sanity_check_paths = {
+    'files': [],
+    'dirs': ['lib/python3.6/site-packages/%(name)s-%(version)s-py3.6-linux-x86_64.egg/%(name)s'],
+}
+
+moduleclass = 'python'
--- a/c/click/click-6.7-Py-3.6.eb
+++ b/c/click/click-6.7-Py-3.6.eb
+# IT4Innovations 2018
+
+easyblock = "PythonPackage"
+name = 'click'
+version = '6.7'
+
+homepage = 'https://pypi.python.org/pypi/click'
+description = 'A simple wrapper around optparse for powerful command line utilities.'
+
+toolchain = {'name': 'Py', 'version': '3.6'}
+
+source_urls = [PYPI_SOURCE]
+sources = [SOURCE_TAR_GZ]
+
+sanity_check_paths = {
+    'files': [],
+    'dirs': ['lib/python3.6/site-packages/%(name)s-%(version)s-py3.6.egg'],
+}
+
+moduleclass = 'python'
--- a/c/cycler/cycler-0.10.0-Py-3.6.eb
+++ b/c/cycler/cycler-0.10.0-Py-3.6.eb
+# IT4Innovations 2018
+
+easyblock = "PythonPackage"
+name = 'cycler'
+version = '0.10.0'
+
+homepage = 'https://matplotlib.org/cycler'
+description = 'Composable style cycles.'
+
+toolchain = {'name': 'Py', 'version': '3.6'}
+
+source_urls = ['https://github.com/matplotlib/cycler/archive']
+sources = ['v%(version)s.tar.gz']
+
+dependencies = [
+    ('six', '1.11.0'),
+]
+
+sanity_check_paths = {
+    'files': ['lib/python3.6/site-packages/%(name)s-%(version)s-py3.6.egg'],
+    'dirs': [],
+}
+
+moduleclass = 'python'
--- a/f/Flask/Flask-0.12.2-Py-3.6.eb
+++ b/f/Flask/Flask-0.12.2-Py-3.6.eb
+# IT4Innovations 2018
+
+easyblock = "PythonPackage"
+name = 'Flask'
+version = '0.12.2'
+
+homepage = 'https://pypi.python.org/pypi/flask'
+description = 'A microframework based on Werkzeug, Jinja2 and good intentions.'
+
+toolchain = {'name': 'Py', 'version': '3.6'}
+
+source_urls = [PYPI_SOURCE]
+sources = [SOURCE_TAR_GZ]
+
+dependencies = [
+    ('click', '6.7'),
+    ('Jinja2', '2.10'),
+    ('MarkupSafe', '1.0'),
+    ('itsdangerous', '0.24'),
+    ('Werkzeug', '0.14.1'),
+]
+
+sanity_check_paths = {
+    'files': [],
+    'dirs': ['lib/python3.6/site-packages/%(name)s-%(version)s-py3.6.egg'],
+}
+
+moduleclass = 'python'
--- a/i/icc/icc-2017.4.196-GCC-6.3.0-2.27.eb
+++ b/i/icc/icc-2017.4.196-GCC-6.3.0-2.27.eb
+name = 'icc'
+version = '2017.4.196'
+
+homepage = 'http://software.intel.com/en-us/intel-compilers/'
+description = "Intel C and C++ compilers"
+
+toolchain = {'name': 'dummy', 'version': ''}
+
+sources = ['parallel_studio_xe_%(version_major)s_update%(version_minor)s_composer_edition_for_cpp.tgz']
+
+checksums = ['6b9b57dada0ec68e394866ec0a8b162c9233de18a7a6dd2dcc956d335e06acbc']
+
+gccver = '6.3.0'
+binutilsver = '2.27'
+versionsuffix = '-GCC-%s-%s' % (gccver, binutilsver)
+
+dependencies = [
+    ('GCCcore', gccver),
+    ('binutils', binutilsver, '', ('GCCcore', gccver)),
+]
+
+# list of regex for components to install
+# full list of components can be obtained from pset/mediaconfig.xml in unpacked sources
+# cfr. https://software.intel.com/en-us/articles/intel-composer-xe-2015-silent-installation-guide
+components = ['intel-comp', 'intel-ccomp', 'intel-icc', 'intel-openmp', 'intel-ipsc?_', 'intel-gdb', 'intel-gdb(?!.*mic)']
+
+dontcreateinstalldir = 'True'
+
+license_file = '/apps/licenses/intel/license.lic' 
+
+moduleclass = 'compiler'
--- a/i/iccifort/iccifort-2017.4.196-GCC-6.3.0-2.27.eb
+++ b/i/iccifort/iccifort-2017.4.196-GCC-6.3.0-2.27.eb
+easyblock = 'Toolchain'
+
+name = 'iccifort'
+version = '2017.4.196'
+versionsuffix = '-GCC-6.3.0-2.27'
+
+homepage = 'http://software.intel.com/en-us/intel-cluster-toolkit-compiler/'
+description = "Intel C, C++ & Fortran compilers"
+
+toolchain = {'name': 'dummy', 'version': ''}
+
+dependencies = [
+    ('icc', version, versionsuffix),
+    ('ifort', version, versionsuffix),
+]
+
+moduleclass = 'toolchain'
--- a/i/ifort/ifort-2017.4.196-GCC-6.3.0-2.27.eb
+++ b/i/ifort/ifort-2017.4.196-GCC-6.3.0-2.27.eb
+name = 'ifort'
+version = '2017.4.196'
+
+homepage = 'http://software.intel.com/en-us/intel-compilers/'
+description = "Intel Fortran compiler"
+
+toolchain = {'name': 'dummy', 'version': ''}
+
+sources = ['parallel_studio_xe_%(version_major)s_update%(version_minor)s_composer_edition_for_fortran.tgz']
+
+checksums = ['0b6a222e015f776600b12b17c19506249c9e7691a8d287f44cd40a66ca9ac749']
+
+# remove dependency on intel-mpi-rt-mic
+patches = ['ifort_2017_no_mpi_mic_dependency.patch']
+
+gccver = '6.3.0'
+binutilsver = '2.27'
+versionsuffix = '-GCC-%s-%s' % (gccver, binutilsver)
+
+dependencies = [
+    ('GCCcore', gccver),
+    ('binutils', binutilsver, '', ('GCCcore', gccver)),
+]
+
+# list of regex for components to install
+# full list of components can be obtained from pset/mediaconfig.xml in unpacked sources
+# cfr. https://software.intel.com/en-us/articles/intel-composer-xe-2015-silent-installation-guide
+components = ['intel-comp', 'intel-fcomp', 'intel-ifort', 'intel-openmp', 'intel-ipsf?_', 'intel-gdb']
+
+dontcreateinstalldir = 'True'
+
+license_file = '/apps/licenses/intel/license.lic'
+
+moduleclass = 'compiler'
--- a/i/iimpi/iimpi-2017b.eb
+++ b/i/iimpi/iimpi-2017b.eb
@@ -9,7 +9,7 @@ description = """Intel C/C++ and Fortran compilers, alongside Intel MPI."""
 toolchain = {'name': 'dummy', 'version': ''}

 compver = '2017.4.196'
-suff = '-GCC-6.4.0-2.28'
+suff = '-GCC-6.3.0-2.27'
 dependencies = [
    ('icc', compver, suff),
    ('ifort', compver, suff),

--- a/i/impi/impi-2017.3.196-iccifort-2017.4.196-GCC-6.4.0-2.28.eb
+++ b/i/impi/impi-2017.3.196-iccifort-2017.4.196-GCC-6.4.0-2.28.eb
@@ -4,7 +4,7 @@ version = '2017.3.196'
 homepage = 'http://software.intel.com/en-us/intel-mpi-library/'
 description = "Intel MPI Library, compatible with MPICH ABI"

-toolchain = {'name': 'iccifort', 'version': '2017.4.196-GCC-6.4.0-2.28'}
+toolchain = {'name': 'iccifort', 'version': '2017.4.196-GCC-6.3.0-2.27'}

 sources = ['l_mpi_%(version)s.tgz']

@@ -15,7 +15,7 @@ dontcreateinstalldir = 'True'
 components = ['intel-mpi', 'intel-psxe', 'intel-imb']

 # set up all the mpi commands to default to intel compilers
-# set_mpi_wrappers_all = 'True'
+set_mpi_wrappers_all = 'True'

 postinstallcmds = [
    'ln -s %(installdir)s/lib64/libmpi.so  %(installdir)s/lib64/libmpich.so',

--- a/i/intel/intel-2017b.eb
+++ b/i/intel/intel-2017b.eb
@@ -9,8 +9,8 @@ description = "Compiler toolchain including Intel compilers, Intel MPI and Intel
 toolchain = {'name': 'dummy', 'version': ''}

 compver = '2017.4.196'
-gccver = '6.4.0'
-binutilsver = '2.28'
+gccver = '6.3.0'
+binutilsver = '2.27'
 gccsuff = '-GCC-%s-%s' % (gccver, binutilsver)
 dependencies = [
    ('GCCcore', gccver),

--- a/i/itsdangerous/itsdangerous-0.24-Py-3.6.eb
+++ b/i/itsdangerous/itsdangerous-0.24-Py-3.6.eb
+# IT4Innovations 2018
+
+easyblock = "PythonPackage"
+name = 'itsdangerous'
+version = '0.24'
+
+homepage = 'https://pypi.python.org/pypi/itsdangerous'
+description = 'Various helpers to pass trusted data to untrusted environments and back.'
+
+toolchain = {'name': 'Py', 'version': '3.6'}
+
+source_urls = [PYPI_SOURCE]
+sources = [SOURCE_TAR_GZ]
+
+sanity_check_paths = {
+    'files': [],
+    'dirs': ['lib/python3.6/site-packages/%(name)s-%(version)s-py3.6.egg'],
+}
+
+moduleclass = 'python'
--- a/j/Jinja2/Jinja2-2.10-Py-3.6.eb
+++ b/j/Jinja2/Jinja2-2.10-Py-3.6.eb
+# IT4Innovations 2018
+
+easyblock = "PythonPackage"
+name = 'Jinja2'
+version = '2.10'
+
+homepage = 'https://pypi.python.org/pypi/jinja'
+description = 'A small but fast and easy to use stand-alone template engine written in pure python.'
+
+toolchain = {'name': 'Py', 'version': '3.6'}
+
+source_urls = [PYPI_SOURCE]
+sources = [SOURCE_TAR_GZ]
+
+dependencies = [
+    ('MarkupSafe', '1.0'),
+]
+
+sanity_check_paths = {
+    'files': [],
+    'dirs': ['lib/python3.6/site-packages/%(name)s-%(version)s-py3.6.egg'],
+}
+
+moduleclass = 'python'
--- a/m/MarkupSafe/MarkupSafe-1.0-Py-3.6.eb
+++ b/m/MarkupSafe/MarkupSafe-1.0-Py-3.6.eb
+# IT4Innovations 2018
+
+easyblock = "PythonPackage"
+name = 'MarkupSafe'
+version = '1.0'
+
+homepage = 'https://pypi.python.org/pypi/markupsafe'
+description = 'Implements a XML/HTML/XHTML Markup safe string for Python.'
+
+toolchain = {'name': 'Py', 'version': '3.6'}
+
+source_urls = [PYPI_SOURCE]
+sources = [SOURCE_TAR_GZ]
+
+sanity_check_paths = {
+    'files': [],
+    'dirs': ['lib/python3.6/site-packages/%(name)s-%(version)s-py3.6-linux-x86_64.egg'],
+}
+
+moduleclass = 'python'
--- a/m/matplotlib/matplotlib-2.1.1-Python-3.6.2-base.eb
+++ b/m/matplotlib/matplotlib-2.1.1-Python-3.6.2-base.eb
@@ -3,26 +3,24 @@
 easyblock = "PythonPackage"
 name = 'matplotlib'
 version = '2.1.1'
-versionsuffix = "-Python-%(pyver)s-base"

 homepage = 'http://matplotlib.org'
 description = """Matplotlib is a python 2D plotting library which produces publication quality figures in a variety of
 hardcopy formats and interactive environments across platforms. matplotlib can be used in python scripts, the python
 and ipython shell, web application servers, and six graphical user interface toolkits."""

-toolchain = {'name': 'dummy', 'version': ''}
+toolchain = {'name': 'Py', 'version': '3.6'}

 source_urls = ['https://github.com/matplotlib/matplotlib/archive/']
 sources = ['v%(version)s.tar.gz']

 dependencies = [
-    ('Python', '3.6.2', '-base'),
-    ('freetype', '2.8'),
-    ('libpng', '1.6.29'),
-    ('python-dateutil', '2.6.1', versionsuffix),
-    ('numpy', '1.13.3', versionsuffix),
-    ('pyparsing', '2.2.0', versionsuffix),
-    ('six', '1.11.0', versionsuffix),
+    ('freetype', '2.8', '', True),
+    ('libpng', '1.6.29', '', True),
+    ('python-dateutil', '2.6.1'),
+    ('numpy', '1.13.3'),
+    ('pyparsing', '2.2.0'),
+    ('six', '1.11.0'),
 ]

 sanity_check_paths = {
@@ -30,4 +28,4 @@ sanity_check_paths = {
    'dirs': ['lib/python3.6/site-packages/%(name)s-%(version)s-py3.6-linux-x86_64.egg/%(name)s'],
 }

-moduleclass = 'vis'
+moduleclass = 'python'
--- a/n/numpy/numpy-1.13.3-Python-3.6.2-base.eb
+++ b/n/numpy/numpy-1.13.3-Python-3.6.2-base.eb
@@ -4,28 +4,20 @@ easyblock = 'PythonPackage'

 name = 'numpy'
 version = '1.13.3'
-versionsuffix = '-Python-%(pyver)s-base'

 homepage = 'http://www.numpy.org'
 description = """NumPy is the fundamental package needed for scientific computing with Python."""

-toolchain = {'name': 'dummy', 'version': ''}
+toolchain = {'name': 'Py', 'version': '3.6'}

 source_urls = ['https://github.com/numpy/numpy/releases/download/v%(version)s']
 sources = ['%(name)s-%(version)s.tar.gz']

-dependencies = [
-    ('Python', '3.6.2', '-base'),
-]
-
-#use_pip = True
-#unpack_sources = False
-
 sanity_check_paths = {
    'files': [],
-    'dirs': ['lib/python%(pyshortver)s/site-packages/numpy-1.13.3-py3.6-linux-x86_64.egg/numpy'],
+    'dirs': ['lib/python3.6/site-packages/numpy-%(version)s-py3.6-linux-x86_64.egg/numpy'],
 }

 sanity_check_commands = [('python', '-c "import numpy; assert(numpy.__version__ == \'%(version)s\')"')]

-moduleclass = 'math'
+moduleclass = 'python'
--- a/p/Py/Py-2.7.eb
+++ b/p/Py/Py-2.7.eb
+# IT4Innovations 2018
+
+easyblock = "Toolchain"
+
+name = 'Py'
+version = '2.7'
+
+homepage = 'https://www.python.org'
+description = """Python 2.7 toolchain"""
+
+toolchain = {'name': 'dummy', 'version': 'dummy'}
+
+dependencies = [ 
+    ('Python', '2.7.14', '-base'),
+]
+
+moduleclass = 'toolchain'
--- a/p/Py/Py-3.6.eb
+++ b/p/Py/Py-3.6.eb
+# IT4Innovations 2018
+
+easyblock = "Toolchain"
+
+name = 'Py'
+version = '3.6'
+
+homepage = 'https://www.python.org'
+description = """Python 3.6 toolchain"""
+
+toolchain = {'name': 'dummy', 'version': 'dummy'}
+
+dependencies = [
+    ('Python', '3.6.4', '-base'), 
+]
+
+moduleclass = 'toolchain'
--- a/p/Python/.Python-3.6.4-base.eb.swp
+++ b/p/Python/.Python-3.6.4-base.eb.swp
--- a/p/Python/Python-2.7.14-base.eb
+++ b/p/Python/Python-2.7.14-base.eb
+# IT4Innovations 2018
+
+easyblock = "EB_Python"
+name = 'Python'
+version = '2.7.14'
+versionsuffix = '-base'
+
+homepage = 'http://python.org/'
+description = "Python is a programming language that lets you work more quickly and integrate your systems more effectively."
+
+toolchain = {'name': 'dummy', 'version': ''}
+toolchainopts = {'pic': True, 'opt': True, 'optarch': True}
+
+source_urls = ['http://www.python.org/ftp/%(namelower)s/%(version)s/']
+sources = [SOURCE_TGZ]
+
+dependencies = [
+    ('bzip2', '1.0.6'),
+    ('zlib', '1.2.11'),
+    ('libreadline', '7.0'),
+    ('ncurses', '6.0'),
+    ('SQLite', '3.17.0'),
+    ('Tk', '8.6.6'),
+]
+
+osdependencies = [('openssl-devel', 'libssl-dev', 'libopenssl-devel')]
+
+#buildopts = 'CPPFLAGS="-I/apps/all/bzip2/1.0.6/include -I/apps/all/zlib/1.2.8/include -I/apps/all/ncurses/5.9/include -I/apps/all/SQLite/3.8.8.1/include" LDFLAGS="-L/apps/all/bzip2/1.0.6/lib -L/apps/all/zlib/1.2.8/lib -L/apps/all/ncurses/5.9/lib -L/apps/all/SQLite/3.8.8.1/lib:$CPPFLAGS"'
+
+exts_list = [
+    ('setuptools', '36.0.1', {
+        'source_urls': ['https://pypi.python.org/packages/source/s/setuptools/'],
+        'source_tmpl': '%(name)s-%(version)s.zip',
+    }),
+    ('pip', '9.0.1', {
+        'source_urls': ['http://pypi.python.org/packages/source/p/pip/'],
+    }),
+    ('nose', '1.3.7', {
+        'source_urls': ['http://pypi.python.org/packages/source/n/nose/'],
+    }),
+]
+
+moduleclass = 'lang'
--- a/p/Python/Python-3.6.4-base.eb
+++ b/p/Python/Python-3.6.4-base.eb
+# IT4Innovations 2018
+
+name = 'Python'
+version = '3.6.4'
+versionsuffix = '-base'
+
+homepage = 'http://python.org/'
+description = "Python is a programming language that lets you work more quickly and integrate your systems more effectively."
+
+toolchain = {'name': 'dummy', 'version': ''}
+toolchainopts = {'pic': True, 'opt': True, 'optarch': True}
+
+source_urls = ['http://www.python.org/ftp/%(namelower)s/%(version)s/']
+sources = [SOURCE_TGZ]
+
+# python needs bzip2 to build the bz2 package
+dependencies = [
+    ('bzip2', '1.0.6'),
+    ('libreadline', '7.0'),
+    ('SQLite', '3.17.0'),
+    ('Tk', '8.6.6'),
+    ('GMP', '6.1.2'),
+    ('XZ', '5.2.3'),
+    ('zlib', '1.2.11'),
+    ('ncurses', '6.0'),
+#   ('OpenSSL', '1.0.1q'),  # OS dependency should be preferred if the os version is more recent then this version, it's
+#   nice to have an up to date openssl for security reasons
+]
+
+osdependencies = [('openssl-devel', 'libssl-dev')]
+
+# order is important!
+# package versions updated Feb 25th 2016
+exts_list = [
+    ('setuptools', '20.1.1', {
+        'source_urls': ['https://pypi.python.org/packages/source/s/setuptools/'],
+    }),
+    ('pip', '8.0.2', {
+        'source_urls': ['https://pypi.python.org/packages/source/p/pip/'],
+    }),
+    ('nose', '1.3.7', {
+        'source_urls': ['https://pypi.python.org/packages/source/n/nose/'],
+    }),
+]
+
+#modluafooter = 'add_property("state","experimental")'
+
+moduleclass = 'lang'
--- a/p/pyparsing/pyparsing-2.2.0-Python-3.6.2-base.eb
+++ b/p/pyparsing/pyparsing-2.2.0-Python-3.6.2-base.eb
@@ -3,24 +3,19 @@
 easyblock = "PythonPackage"
 name = 'pyparsing'
 version = '2.2.0'
-versionsuffix = "-Python-%(pyver)s-base"

 homepage = 'http://pyparsing.wikispaces.com'
 description = """The pyparsing module provides a library of classes 
  that client code uses to construct the grammar directly in Python code."""

-toolchain = {'name': 'dummy', 'version': ''}
+toolchain = {'name': 'Py', 'version': '3.6'}

-source_urls = ['https://pypi.python.org/packages/3c/ec/a94f8cf7274ea60b5413df054f82a8980523efd712ec55a59e7c3357cf7c/']
+source_urls = [PYPI_SOURCE]
 sources = [SOURCE_TAR_GZ]

-dependencies = [
-    ('Python', '3.6.2', '-base'),
-]
-
 sanity_check_paths = {
    'files': ['lib/python3.6/site-packages/%(name)s-%(version)s-py3.6.egg'],
    'dirs': [],
 }

-moduleclass = 'vis'
+moduleclass = 'python'
--- a/p/python-dateutil/python-dateutil-2.6.1-Python-3.6.2-base.eb
+++ b/p/python-dateutil/python-dateutil-2.6.1-Python-3.6.2-base.eb
@@ -3,19 +3,17 @@
 easyblock = "PythonPackage"
 name = 'python-dateutil'
 version = '2.6.1'
-versionsuffix = "-Python-%(pyver)s-base"

 homepage = 'https://github.com/dateutil/dateutil'
-description = 'Useful extensions to the standard Python datetime features'
+description = 'Useful extensions to the standard Python datetime features.'

-toolchain = {'name': 'dummy', 'version': ''}
+toolchain = {'name': 'Py', 'version': '3.6'}

 source_urls = ['https://github.com/dateutil/dateutil/releases/download/%(version)s']
 sources = [SOURCE_TAR_GZ]

 dependencies = [
-    ('Python', '3.6.2', '-base'),
-    ('six', '1.11.0', versionsuffix),
+    ('six', '1.11.0'),
 ]

 options = {'modulename': 'dateutil'}
@@ -25,4 +23,4 @@ sanity_check_paths = {
    'dirs': [],
 }

-moduleclass = 'vis'
+moduleclass = 'python'
--- a/p/pytz/pytz-2017.3-Py-3.6.eb
+++ b/p/pytz/pytz-2017.3-Py-3.6.eb
+# IT4Innovations 2018
+
+easyblock = "PythonPackage"
+name = 'pytz'
+version = '2017.3'
+
+homepage = 'http://pytz.sourceforge.net/'
+description = """pytz brings the Olson tz database into Python. This library allows 
+  accurate and cross platform timezone calculations using Python 2.4 or higher."""
+
+toolchain = {'name': 'Py', 'version': '3.6'}
+
+source_urls = ['https://pypi.python.org/packages/60/88/d3152c234da4b2a1f7a989f89609ea488225eaea015bc16fbde2b3fdfefa']
+sources = [SOURCE_ZIP]
+
+sanity_check_paths = {
+    'files': ['lib/python3.6/site-packages/%(name)s-%(version)s-py3.6.egg'],
+    'dirs': [],
+}
+
+moduleclass = 'python'
--- a/s/scipy/scipy-1.0.0-Python-3.6.2-base.eb
+++ b/s/scipy/scipy-1.0.0-Python-3.6.2-base.eb
@@ -4,9 +4,9 @@ easyblock = 'PythonPackage'

 name = 'scipy'
 version = '1.0.0'
-versionsuffix = '-Python-%(pyver)s-base'
+versionsuffix = '-Py-3.6'

-homepage = 'http://scipy.org/scipylib'
+homepage = 'http://scipy.org'
 description = """SciPy (pronounced 'Sigh Pie') is open-source software for mathematics, science, and engineering.
  It includes modules for statistics, optimization, integration, linear algebra, Fourier transforms, signal and 
  image processing, ODE solvers, and more."""
@@ -16,19 +16,21 @@ source_urls = ['https://github.com/scipy/scipy/releases/download/v%(version)s']
 sources = [SOURCELOWER_TAR_GZ]

 dependencies = [
-    ('Python', '3.6.2', '-base'),
-    ('numpy', '1.13.3', versionsuffix),
+    ('Py', '3.6'),
+    ('numpy', '1.13.3', '-Py-3.6'),
 ]

 builddependencies = [
-    ('imkl', '2017.1.132', '-iimpi-2017a'),
+    ('imkl', '2017.1.132', '', ('iimpi', '2017a')),
+#    ('LAPACK', '3.7.1', '', ('gompi', '2017a')),
+#    ('OpenBLAS', '0.2.19', '-LAPACK-3.7.0', ('GCC', '6.3.0-2.27')),
 ]

 sanity_check_paths = {
    'files': [],
-    'dirs': ['lib/python%(pyshortver)s/site-packages/scipy-1.0.0-py3.6-linux-x86_64.egg/scipy'],
+    'dirs': ['lib/python3.6/site-packages/scipy-1.0.0-py3.6-linux-x86_64.egg/scipy'],
 }

 sanity_check_commands = [('python', '-c "import scipy; assert(scipy.__version__ == \'%(version)s\')"')]

-moduleclass = 'math'
+moduleclass = 'python'
--- a/s/six/six-1.11.0-Py-2.7.eb
+++ b/s/six/six-1.11.0-Py-2.7.eb
+# IT4Innovations 2018
+
+easyblock = "PythonPackage"
+name = 'six'
+version = '1.11.0'
+
+homepage = 'https://github.com/benjaminp/six'
+description = 'Python 2 and 3 compatibility library.'
+
+toolchain = {'name': 'Py', 'version': '2.7'}
+
+source_urls = ['https://github.com/benjaminp/six/archive/']
+sources = ['%(version)s.tar.gz']
+
+sanity_check_paths = {
+    'files': [],
+    'dirs': ['lib/python2.7/site-packages/%(name)s-%(version)s-py2.7.egg'],
+}
+
+moduleclass = 'python'
--- a/s/six/six-1.11.0-Python-3.6.2-base.eb
+++ b/s/six/six-1.11.0-Python-3.6.2-base.eb
@@ -3,23 +3,18 @@
 easyblock = "PythonPackage"
 name = 'six'
 version = '1.11.0'
-versionsuffix = "-Python-%(pyver)s-base"

 homepage = 'https://github.com/benjaminp/six'
 description = 'Python 2 and 3 compatibility library.'

-toolchain = {'name': 'dummy', 'version': ''}
+toolchain = {'name': 'Py', 'version': '3.6'}

 source_urls = ['https://github.com/benjaminp/six/archive/']
 sources = ['%(version)s.tar.gz']

-dependencies = [
-    ('Python', '3.6.2', '-base'),
-]
-
 sanity_check_paths = {
    'files': [],
    'dirs': ['lib/python3.6/site-packages/%(name)s-%(version)s-py3.6.egg'],
 }

-moduleclass = 'vis'
+moduleclass = 'python'
--- a/s/spglib-python/spglib-python-1.10.2.4-Py-3.6.eb
+++ b/s/spglib-python/spglib-python-1.10.2.4-Py-3.6.eb
+# IT4Innovations 2018
+
+easyblock = "PythonPackage"
+name = 'spglib-python'
+version = '1.10.2.4'
+
+homepage = 'https://pypi.python.org/pypi/spglib'
+description = 'Spglib for Python. Spglib is a library for finding and handling crystal symmetries written in C.'
+
+toolchain = {'name': 'Py', 'version': '3.6'}
+
+source_urls = ['https://pypi.python.org/packages/8a/7a/3f74fda3760e1fff770c4af0705874722f735f48be6610e9975c9fc6496a']
+sources = ['spglib-%(version)s.tar.gz']
+
+options = {'modulename': 'spglib'}
+
+sanity_check_paths = {
+    'files': [],
+    'dirs': ['lib/python3.6/site-packages/spglib-%(version)s-py3.6-linux-x86_64.egg'],
+}
+
+moduleclass = 'python'
--- a/w/Werkzeug/Werkzeug-0.14.1-Py-3.6.eb
+++ b/w/Werkzeug/Werkzeug-0.14.1-Py-3.6.eb
+# IT4Innovations 2018
+
+easyblock = "PythonPackage"
+name = 'Werkzeug'
+version = '0.14.1'
+
+homepage = 'https://pypi.python.org/pypi/Werkzeug'
+description = 'The comprehensive WSGI web application library.'
+
+toolchain = {'name': 'Py', 'version': '3.6'}
+
+source_urls = [PYPI_SOURCE]
+sources = [SOURCE_TAR_GZ]
+
+#dependencies = [
+#    ('Jinja2', '2.10'),
+
+#]
+
+sanity_check_paths = {
+    'files': [],
+    'dirs': ['lib/python3.6/site-packages/%(name)s-%(version)s-py3.6.egg'],