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8 changes: 4 additions & 4 deletions easybuild/easyconfigs/n/NBO/NBO-7.0-intel-2017b.eb
Original file line number Diff line number Diff line change
Expand Up @@ -20,11 +20,11 @@ checksums = [
'832e2f29f728d15e114b81978d3308ab7b1b7c73deccadd2a562a5ecfd7f27f4', # NBO-7.0_make.patch
]

intlength = 'i8' # change to i4 if Gaussian was compiled with 32-bit integers
local_intlength = 'i8' # change to i4 if Gaussian was compiled with 32-bit integers

buildopts = 'FC=$FC CC=$CC NBODIR="%(builddir)s/nbo7" STATIC="false" PROFILE="true" '
buildopts += 'BLASLIB="$LDFLAGS $LIBBLAS" '
buildopts += 'INT=%s ' % intlength
buildopts += 'INT=%s ' % local_intlength

parallel = 1

Expand All @@ -33,11 +33,11 @@ files_to_copy = ['bin', 'dox', 'man', 'tests']
postinstallcmds = [
'sed -i -e "s|setenv GAUNBO.*|setenv GAUNBO g16nbo|" %(installdir)s/bin/gaunbo{6,7}',
'sed -i -e "s|setenv BINDIR.*|setenv BINDIR %(installdir)s/bin|" %(installdir)s/bin/gaunbo{6,7}',
'sed -i -e "s|setenv INT.*|setenv INT %s|" %%(installdir)s/bin/gaunbo{6,7}' % intlength,
'sed -i -e "s|setenv INT.*|setenv INT %s|" %%(installdir)s/bin/gaunbo{6,7}' % local_intlength,
]

sanity_check_paths = {
'files': ['bin/%s.%s.exe' % (x, intlength) for x in ('gennbo', 'g09nbo', 'g16nbo', 'nbo7')],
'files': ['bin/%s.%s.exe' % (x, local_intlength) for x in ('gennbo', 'g09nbo', 'g16nbo', 'nbo7')],
'dirs': [],
}

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8 changes: 4 additions & 4 deletions easybuild/easyconfigs/n/NCCL/NCCL-2.1.4-CUDA-9.0.176.eb
Original file line number Diff line number Diff line change
Expand Up @@ -2,8 +2,8 @@ easyblock = "MakeCp"

name = 'NCCL'
version = '2.1.4'
cuda_version = '9.0.176'
versionsuffix = '-CUDA-%s' % cuda_version
local_cuda_version = '9.0.176'
versionsuffix = '-CUDA-%s' % local_cuda_version

homepage = 'https://developer.nvidia.com/nccl'
description = """The NVIDIA Collective Communications Library (NCCL) implements multi-GPU and multi-node collective
Expand All @@ -12,11 +12,11 @@ communication primitives that are performance optimized for NVIDIA GPUs."""
toolchain = SYSTEM

# Sources can be downloaded from https://developer.nvidia.com/nccl/nccl-download but need membership
sources = ['%%(namelower)s_%%(version)s-1+cuda%s_x86_64.txz' % '.'.join(cuda_version.split('.')[0:2])]
sources = ['%%(namelower)s_%%(version)s-1+cuda%s_x86_64.txz' % '.'.join(local_cuda_version.split('.')[0:2])]
checksums = ['7525d3291203b2f91dc48e165248be8c1145a40dca624da0423780ee6e6fbe96']

dependencies = [
('CUDA', cuda_version)
('CUDA', local_cuda_version)
]

skipsteps = ['build']
Expand Down
8 changes: 4 additions & 4 deletions easybuild/easyconfigs/n/NCCL/NCCL-2.2.13-CUDA-9.2.148.1.eb
Original file line number Diff line number Diff line change
Expand Up @@ -2,8 +2,8 @@ easyblock = "MakeCp"

name = 'NCCL'
version = '2.2.13'
cuda_version = '9.2.148.1'
versionsuffix = '-CUDA-%s' % cuda_version
local_cuda_version = '9.2.148.1'
versionsuffix = '-CUDA-%s' % local_cuda_version

homepage = 'https://developer.nvidia.com/nccl'
description = """The NVIDIA Collective Communications Library (NCCL) implements multi-GPU and multi-node collective
Expand All @@ -12,10 +12,10 @@ communication primitives that are performance optimized for NVIDIA GPUs."""
toolchain = SYSTEM

# Download from https://developer.nvidia.com/nccl/nccl-download (after log in)
sources = ['%%(namelower)s_%%(version)s-1+cuda%s_x86_64.txz' % '.'.join(cuda_version.split('.')[0:2])]
sources = ['%%(namelower)s_%%(version)s-1+cuda%s_x86_64.txz' % '.'.join(local_cuda_version.split('.')[0:2])]
checksums = ['2854bb5989dd5f06553bfd1367e718ce09b435f8758d0bd946b955fd41b6a93e']

dependencies = [('CUDA', cuda_version)]
dependencies = [('CUDA', local_cuda_version)]

skipsteps = ['build']

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4 changes: 2 additions & 2 deletions easybuild/easyconfigs/n/NCCL/NCCL-2.3.7-fosscuda-2018b.eb
Original file line number Diff line number Diff line change
Expand Up @@ -10,10 +10,10 @@ communication primitives that are performance optimized for NVIDIA GPUs."""
toolchain = {'name': 'fosscuda', 'version': '2018b'}

# fosscuda/2018b uses CUDA 9.2
cuda_version = '9.2'
local_cuda_version = '9.2'

# Download from https://developer.nvidia.com/nccl/nccl-download (after log in)
sources = ['%%(namelower)s_%%(version)s-1+cuda%s_x86_64.txz' % cuda_version]
sources = ['%%(namelower)s_%%(version)s-1+cuda%s_x86_64.txz' % local_cuda_version]
checksums = ['f714ef17ce9616eec1f125c44b6542fdf6f92bd82248064ea60dfe33b3d986d8']

skipsteps = ['build']
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4 changes: 2 additions & 2 deletions easybuild/easyconfigs/n/NCCL/NCCL-2.4.2-gcccuda-2019a.eb
Original file line number Diff line number Diff line change
Expand Up @@ -10,10 +10,10 @@ communication primitives that are performance optimized for NVIDIA GPUs."""
# gcccuda/2019a uses CUDA 10.1
toolchain = {'name': 'gcccuda', 'version': '2019a'}

cuda_version = '10.1'
local_cuda_version = '10.1'

# Download from https://developer.nvidia.com/nccl/nccl-download (after log in)
sources = ['%%(namelower)s_%%(version)s-1+cuda%s_x86_64.txz' % cuda_version]
sources = ['%%(namelower)s_%%(version)s-1+cuda%s_x86_64.txz' % local_cuda_version]
checksums = ['27dad0e9495d2382e34d2701472a702007be65275b22f782e74613af08e0a39b']

skipsteps = ['build']
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12 changes: 6 additions & 6 deletions easybuild/easyconfigs/n/NCL/NCL-6.4.0-intel-2017a.eb
Original file line number Diff line number Diff line change
Expand Up @@ -13,22 +13,22 @@ sources = ['%(namelower)s_ncarg-%(version)s.tar.gz']

patches = ['NCL-%(version)s_fix-types.patch']

hdf5_ver = '1.8.18'
local_hdf5_ver = '1.8.18'
dependencies = [
('cURL', '7.53.1'),
('JasPer', '1.900.1'),
('g2lib', '1.4.0'),
('g2clib', '1.6.0'),
('HDF', '4.2.12'),
('HDF5', hdf5_ver),
('netCDF', '4.4.1.1', '-HDF5-%s' % hdf5_ver),
('netCDF-Fortran', '4.4.4', '-HDF5-%s' % hdf5_ver),
('HDF5', local_hdf5_ver),
('netCDF', '4.4.1.1', '-HDF5-%s' % local_hdf5_ver),
('netCDF-Fortran', '4.4.4', '-HDF5-%s' % local_hdf5_ver),
('Szip', '2.1'),
('freetype', '2.7.1', '-libpng-1.6.29'),
('zlib', '1.2.11'),
('GDAL', '2.2.0', '-Python-2.7.13-HDF5-%s' % hdf5_ver),
('GDAL', '2.2.0', '-Python-2.7.13-HDF5-%s' % local_hdf5_ver),
('UDUNITS', '2.2.24'),
('ESMF', '6.3.0rp1', '-HDF5-%s' % hdf5_ver),
('ESMF', '6.3.0rp1', '-HDF5-%s' % local_hdf5_ver),
('bzip2', '1.0.6'),
('cairo', '1.14.8'),
('libiconv', '1.15'),
Expand Down
10 changes: 5 additions & 5 deletions easybuild/easyconfigs/n/NCL/NCL-6.4.0-intel-2017b.eb
Original file line number Diff line number Diff line change
Expand Up @@ -12,20 +12,20 @@ sources = ['%(namelower)s_ncarg-%(version)s.tar.gz']

patches = ['NCL-%(version)s_fix-types.patch']

hdf5_ver = '1.8.19'
local_hdf5_ver = '1.8.19'
dependencies = [
('cURL', '7.56.0'),
('JasPer', '1.900.1'),
('g2lib', '1.4.0'),
('g2clib', '1.6.0'),
('HDF', '4.2.13'),
('HDF5', hdf5_ver),
('netCDF', '4.4.1.1', '-HDF5-%s' % hdf5_ver),
('netCDF-Fortran', '4.4.4', '-HDF5-%s' % hdf5_ver),
('HDF5', local_hdf5_ver),
('netCDF', '4.4.1.1', '-HDF5-%s' % local_hdf5_ver),
('netCDF-Fortran', '4.4.4', '-HDF5-%s' % local_hdf5_ver),
('Szip', '2.1.1'),
('freetype', '2.8'),
('zlib', '1.2.11'),
('GDAL', '2.2.2', '-Python-2.7.14-HDF5-%s' % hdf5_ver),
('GDAL', '2.2.2', '-Python-2.7.14-HDF5-%s' % local_hdf5_ver),
('UDUNITS', '2.2.25'),
('ESMF', '7.0.2'),
('bzip2', '1.0.6'),
Expand Down
4 changes: 1 addition & 3 deletions easybuild/easyconfigs/n/NCL/NCL-6.4.0-intel-2018a.eb
Original file line number Diff line number Diff line change
Expand Up @@ -16,15 +16,13 @@ checksums = [
'be687fbae51b0aa8a97d9ecd64069f9881f600516cf8aea513ebd47fc4cbe7df', # NCL-6.4.0_fix_HDF5_1.10.x.patch
]

hdf5_ver = '1.10.1'

dependencies = [
('cURL', '7.58.0'),
('JasPer', '2.0.14'),
('g2lib', '1.4.0'),
('g2clib', '1.6.0'),
('HDF', '4.2.14'),
('HDF5', hdf5_ver),
('HDF5', '1.10.1'),
('netCDF', '4.6.0'),
('netCDF-Fortran', '4.4.4'),
('Szip', '2.1.1'),
Expand Down
4 changes: 2 additions & 2 deletions easybuild/easyconfigs/n/NEdit/NEdit-5.5-Linux-x86.eb
Original file line number Diff line number Diff line change
Expand Up @@ -11,8 +11,8 @@ description = """NEdit is a multi-purpose text editor for the X Window System,

toolchain = SYSTEM

subdir = '_'.join(version.split('-')[0].split('.'))
source_urls = ['http://ftp.vim.org/editors/NEdit/v%s/executables' % subdir]
local_subdir = '_'.join(version.split('-')[0].split('.'))
source_urls = ['http://ftp.vim.org/editors/NEdit/v%s/executables' % local_subdir]
sources = ['%(namelower)s-%(version)s%(versionsuffix)s.tar.gz']

modextrapaths = {
Expand Down
Original file line number Diff line number Diff line change
@@ -1,7 +1,7 @@
name = 'NWChem'
version = '6.6.revision27746'
verdate = '2015-10-20'
versionsuffix = '-%s-patches-20170814-Python-%%(pyver)s' % verdate
local_verdate = '2015-10-20'
versionsuffix = '-%s-patches-20170814-Python-%%(pyver)s' % local_verdate

homepage = 'http://www.nwchem-sw.org'
description = """NWChem aims to provide its users with computational chemistry tools that are scalable both in
Expand All @@ -15,7 +15,7 @@ toolchain = {'name': 'intel', 'version': '2017a'}
toolchainopts = {'i8': True}

source_urls = ['http://www.nwchem-sw.org/download.php?f=']
sources = ['Nwchem-%%(version)s-src.%s.tar.bz2' % verdate]
sources = ['Nwchem-%%(version)s-src.%s.tar.bz2' % local_verdate]
patches = [
'NWChem_fix-date.patch',
'NWChem-%(version)s-parallelbuild.patch',
Expand Down
Original file line number Diff line number Diff line change
@@ -1,7 +1,7 @@
name = 'NWChem'
version = '6.6.revision27746'
verdate = '2015-10-20'
versionsuffix = '-%s-Python-%%(pyver)s' % verdate
local_verdate = '2015-10-20'
versionsuffix = '-%s-Python-%%(pyver)s' % local_verdate

homepage = 'http://www.nwchem-sw.org'
description = """NWChem aims to provide its users with computational chemistry tools that are scalable both in
Expand All @@ -15,7 +15,7 @@ toolchain = {'name': 'iomkl', 'version': '2017a'}
toolchainopts = {'i8': True}

source_urls = ['http://www.nwchem-sw.org/download.php?f=']
sources = ['Nwchem-%%(version)s-src.%s.tar.bz2' % verdate]
sources = ['Nwchem-%%(version)s-src.%s.tar.bz2' % local_verdate]

patches = [
'NWChem_fix-date.patch',
Expand Down
Original file line number Diff line number Diff line change
@@ -1,8 +1,8 @@
name = 'NWChem'
revision = 47
version = '6.8.revision%s' % revision
verdate = '2017-12-14'
versionsuffix = '-%s-Python-%%(pyver)s' % verdate
local_revision = 47
version = '6.8.revision%s' % local_revision
local_verdate = '2017-12-14'
versionsuffix = '-%s-Python-%%(pyver)s' % local_verdate

homepage = 'http://www.nwchem-sw.org'
description = """NWChem aims to provide its users with computational chemistry tools that are scalable both in
Expand All @@ -17,7 +17,7 @@ toolchainopts = {'i8': True}

source_urls = ['https://github.com/nwchemgit/nwchem/releases/download/v%(version_major_minor)s-release/']
sources = ['nwchem-%%(version_major_minor)s-release.revision-v%%(version_major_minor)s-%s-gdf6c956-src.%s.tar.bz2'
% (revision, verdate)]
% (local_revision, local_verdate)]
patches = [
'NWChem_fix-date.patch',
]
Expand Down
Original file line number Diff line number Diff line change
@@ -1,8 +1,8 @@
name = 'NWChem'
revision = 47
version = '6.8.revision%s' % revision
verdate = '2017-12-14'
versionsuffix = '-%s-Python-%%(pyver)s' % verdate
local_revision = 47
version = '6.8.revision%s' % local_revision
local_verdate = '2017-12-14'
versionsuffix = '-%s-Python-%%(pyver)s' % local_verdate

homepage = 'http://www.nwchem-sw.org'
description = """NWChem aims to provide its users with computational chemistry tools that are scalable both in
Expand All @@ -17,7 +17,7 @@ toolchainopts = {'i8': True}

source_urls = ['https://github.com/nwchemgit/nwchem/releases/download/v%(version_major_minor)s-release/']
sources = ['nwchem-%%(version_major_minor)s-release.revision-v%%(version_major_minor)s-%s-gdf6c956-src.%s.tar.bz2'
% (revision, verdate)]
% (local_revision, local_verdate)]
patches = [
'NWChem_fix-date.patch',
]
Expand Down
14 changes: 7 additions & 7 deletions easybuild/easyconfigs/n/NetPIPE/NetPIPE-5.1-intel-2018a.eb
Original file line number Diff line number Diff line change
Expand Up @@ -13,17 +13,17 @@ source_urls = ['http://netpipe.cs.ksu.edu/download/']
sources = ['NetPIPE-%(version)s.tar.gz']
checksums = ['0b6e6fd90446d06b70f0e615c56698887d3bb90b8a6be5d6d8a0ccb7efcd7b0b']

common_buildopts = 'CC="$CC" CFLAGS="$CFLAGS -lrt"'
local_common_buildopts = 'CC="$CC" CFLAGS="$CFLAGS -lrt"'

# possible values: disk, ibverbs, memcpy, mpi, shmem, tcp, theo
# shmem requires shmem.h (must be provided by OS?)
buildopts = [
'disk ' + common_buildopts,
'ibverbs ' + common_buildopts,
'memcpy ' + common_buildopts,
'mpi ' + common_buildopts,
'tcp ' + common_buildopts,
'theo ' + common_buildopts,
'disk ' + local_common_buildopts,
'ibverbs ' + local_common_buildopts,
'memcpy ' + local_common_buildopts,
'mpi ' + local_common_buildopts,
'tcp ' + local_common_buildopts,
'theo ' + local_common_buildopts,
]

files_to_copy = [(['NP*'], 'bin')]
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Original file line number Diff line number Diff line change
@@ -1,7 +1,7 @@
name = 'netCDF'
version = '4.4.1.1'
hdf5_ver = '1.10.1'
versionsuffix = '-HDF5-%s' % hdf5_ver
local_hdf5_ver = '1.10.1'
versionsuffix = '-HDF5-%s' % local_hdf5_ver

homepage = 'http://www.unidata.ucar.edu/software/netcdf/'
description = """NetCDF (network Common Data Form) is a set of software libraries
Expand All @@ -16,7 +16,7 @@ sources = ['v%(version)s.tar.gz']
checksums = ['7f040a0542ed3f6d27f3002b074e509614e18d6c515b2005d1537fec01b24909']

dependencies = [
('HDF5', hdf5_ver),
('HDF5', local_hdf5_ver),
('cURL', '7.54.0'),
('Szip', '2.1.1'),
]
Expand Down
Original file line number Diff line number Diff line change
@@ -1,7 +1,7 @@
name = 'netCDF'
version = '4.4.1.1'
hdf5_ver = '1.8.19'
versionsuffix = '-HDF5-%s' % hdf5_ver
local_hdf5_ver = '1.8.19'
versionsuffix = '-HDF5-%s' % local_hdf5_ver

homepage = 'http://www.unidata.ucar.edu/software/netcdf/'
description = """NetCDF (network Common Data Form) is a set of software libraries
Expand All @@ -16,7 +16,7 @@ sources = ['v%(version)s.tar.gz']
checksums = ['7f040a0542ed3f6d27f3002b074e509614e18d6c515b2005d1537fec01b24909']

dependencies = [
('HDF5', hdf5_ver),
('HDF5', local_hdf5_ver),
('cURL', '7.54.0'),
('Szip', '2.1.1'),
]
Expand Down
Original file line number Diff line number Diff line change
@@ -1,7 +1,7 @@
name = 'netCDF'
version = '4.4.1.1'
hdf5_ver = '1.8.19'
versionsuffix = '-HDF5-%s' % hdf5_ver
local_hdf5_ver = '1.8.19'
versionsuffix = '-HDF5-%s' % local_hdf5_ver

homepage = 'http://www.unidata.ucar.edu/software/netcdf/'
description = """NetCDF (network Common Data Form) is a set of software libraries
Expand All @@ -16,7 +16,7 @@ sources = ['v%(version)s.tar.gz']
checksums = ['7f040a0542ed3f6d27f3002b074e509614e18d6c515b2005d1537fec01b24909']

dependencies = [
('HDF5', hdf5_ver),
('HDF5', local_hdf5_ver),
('cURL', '7.56.0'),
('Szip', '2.1.1'),
]
Expand Down
Original file line number Diff line number Diff line change
@@ -1,7 +1,7 @@
name = 'netCDF'
version = '4.4.1.1'
hdf5_ver = '1.10.1'
versionsuffix = '-HDF5-%s' % hdf5_ver
local_hdf5_ver = '1.10.1'
versionsuffix = '-HDF5-%s' % local_hdf5_ver

homepage = 'http://www.unidata.ucar.edu/software/netcdf/'
description = """NetCDF (network Common Data Form) is a set of software libraries
Expand All @@ -16,7 +16,7 @@ sources = ['v%(version)s.tar.gz']
checksums = ['7f040a0542ed3f6d27f3002b074e509614e18d6c515b2005d1537fec01b24909']

dependencies = [
('HDF5', hdf5_ver),
('HDF5', local_hdf5_ver),
('cURL', '7.54.0'),
('Szip', '2.1'),
]
Expand Down
Original file line number Diff line number Diff line change
@@ -1,7 +1,7 @@
name = 'netCDF'
version = '4.4.1.1'
hdf5_ver = '1.8.18'
versionsuffix = '-HDF5-%s' % hdf5_ver
local_hdf5_ver = '1.8.18'
versionsuffix = '-HDF5-%s' % local_hdf5_ver

homepage = 'http://www.unidata.ucar.edu/software/netcdf/'
description = """NetCDF (network Common Data Form) is a set of software libraries
Expand All @@ -17,7 +17,7 @@ source_urls = [
]

dependencies = [
('HDF5', hdf5_ver),
('HDF5', local_hdf5_ver),
('cURL', '7.53.1'),
('Szip', '2.1'),
]
Expand Down
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