Commit graph

15401 commits

Author SHA1 Message Date
Peter Scheibel
e5f04f9abc Bugfix: allow missing modules if they are blacklisted (#13540)
`spack module loads` and `spack module find` previously failed if any upstream modules were missing.  This prevented it from being used with upstreams (or, really, any spack instance) that blacklisted modules.

This PR makes module finding is now more lenient (especially for blacklisted modules).

- `spack module find` now does not report an error if the spec is blacklisted
  - instead, it prints a single warning if any modules will be omitted from the loads file
  - It comments the missing modules out of the loads file so the user can see what's missing
  - Debug messages are also printed so users can check this with `spack -d...`

- also added tests for new functionality
2019-12-04 19:17:40 -08:00
Adam J. Stewart
ba7ac53b75
Fix spack test when SPACK_ROOT isn't set (#13980) 2019-12-04 18:05:08 -06:00
Stephen Hudson
e0e9fb4462 Update libensemble to v0.6.0 (#13987) 2019-12-04 18:01:05 -06:00
Adam J. Stewart
10f4445309
Add latest version of py-scikit-learn (#13979) 2019-12-04 11:47:07 -06:00
Massimiliano Culpo
e9f027210f Fixed x86-64 optimization flags for clang (#13913)
* Fixed x86-64 optimization flags for clang
* Fixed expected results in unit tests

Before the flags used where the one for llc, the underlying compiler from LLVM IR to machine assembly. It turns out that the semantic of `-march`, `-mtune` and `-mcpu` changes from clang front-end to llc.

I found no definitive reference for the flags submitted in this PR, but I checked the assembly on a vectorizable function using Godbolt's web-site.
2019-12-04 09:11:34 -08:00
Tim Haines
728f5a76f3 Add Elfutils 0.178 (#13976)
* Add elfutils-0.178

* Disable debuginfod server

* Fix flake8
2019-12-04 07:50:44 -06:00
Tim Haines
bb33b6b8e6 Use correct range check for the version (#13977)
Update to #13893
2019-12-04 07:50:05 -06:00
Sheng Di
ba87a7f53a Release a new version v2.1.8.0 for SZ (#13974)
* Release a new version v2.1.8.0 for SZ

* add maintainer

* add parallel = False to avoid potential compile issue
2019-12-03 22:35:46 -06:00
Rob Latham
92ee0659e2 mpich: update build requirements (#13966)
To build from git, MPICH will need newer autoconf, automake, and libtool than
typically available on many systems.
2019-12-03 17:13:52 -06:00
Rob Latham
c7dbb4f103 argobots: consistently use 'master' (#13965)
Commit 71cd91e4 changed "latest from git" to 'master' from former
'develop'.  Build dependencies still pointed to @develop, though
2019-12-03 12:09:15 -06:00
Cameron Smith
5ddf5e2e7b new package: Simmetrix SimModSuite (#8730)
* package for Simmetrix SimModSuite

* simmodsuite: passes flake8

* simmetrix: add version, set cmake prefix path

A given install will either use the libs built on rhel7 or rhel6.
For now, I'm sticking with the non-spack install convention of
placing the libraries into sub-directories named according to their
build process (os + compiler).

* simmetrix: add older version

* simmetrix: set build env paths

easier to build pumi using CMAKE_PREFIX_PATH

* simmetrix: address review comments

* simmetrix: add new version and remove old one

* simmetrix: flake8 fixes

* simmodsuite: oslib var is in self

* simmodsuite: update version and checksum

* simodsuite: set LD_LIBRARY_PATH for cad kernels

* update license

* update setup_environment calls

* increase indentation for flake8

* python3.8 flake8 fixes

* use spack consistent naming

Co-Authored-By: Adam J. Stewart <ajstewart426@gmail.com>

* sha256 required, update versions and hashes
2019-12-03 12:07:27 -06:00
t-karatsu
111dc8f823 kaldi: Change process of version analysis when using Fujitsu compiler. (#13960) 2019-12-03 10:34:05 -06:00
asmaahassan90
fb52f1c7e2 fix_cantera_installation (#13962)
For a successful cantera installation, googletest has to be installed with gmock on, and sundials has to be of version less than 3.2
2019-12-03 10:33:27 -06:00
Phil Carns
88680febc9 bump libfabric to 1.9.0 (#13964) 2019-12-03 10:32:53 -06:00
Yuanqi Wang
a5d872f510 Update MrBayes to 3.2.7a and correct MPI variants (#13929)
* Update MrBayes and correct MPI variant

* Use tarballs and remove autotools dependencies

* MrBayes: remove ISA variants
2019-12-03 10:31:00 -06:00
Jannek Squar
7e2d01b238 Update package libgpg error (#13697)
* Added build dependency on gawk

* Use virtual depdendency

* Added patch to prepare libgpg-error for use with gawk@5

* Added reasoning with link for need for patch
2019-12-03 10:29:15 -06:00
Chris White
cb38725a88 Add missing metis include to superlu-dist (#13956)
* Add missing metis include to superlu-dist

* Fix PEP-8 line length

* Fix PEP-8 indent
2019-12-02 18:30:23 -06:00
Sinan
4f8a2eeca2 add more versions (#13957) 2019-12-02 18:30:08 -06:00
Massimiliano Culpo
a93a613668
Speedup environment activation (#13557)
* Add a transaction around repeated calls to `spec.prefix` in the activation process
* cache the computation of home in the python package to speed up setting deps
* ensure that module-scope variables are only set *once* per module
2019-12-02 14:05:35 -08:00
Massimiliano Culpo
bca59f8d83 Speedup environment activation (#13557)
* Add a transaction around repeated calls to `spec.prefix` in the activation process
* cache the computation of home in the python package to speed up setting deps
* ensure that module-scope variables are only set *once* per module
2019-12-02 14:05:02 -08:00
Hector Martinez-Seara
1b624b9d45 amber: Improved package.py and added version 18 (#13945)
* amber: Improved package.py and added version 18

- Added amber 18 with ambertools 19
- Added all available patches
- Added +update variant to use the self update
- Added +openmp variant to get openmp optomizations
- Added +x11 variant when possible
- Splitted amber 16 and 18 dependencies
- We now detect the copiler type and compile accordingly
- Added cray variant which is a bit special (untested)
- Improved detection of possible cuda versions
- All compilation optimizations +mpi +openmp +cuda are compatible
- Updated to use setup_build_environment(), setup_run_environment()

* dealii: Added 'threads' variant that controls the TBB dependency (#13931)

* dealii: Added 'threads' variant that controls the DEAL_II_WITH_THREADS cmake option and the dependency on Intel TBB

* Update var/spack/repos/builtin/packages/dealii/package.py

Co-Authored-By: Adam J. Stewart <ajstewart426@gmail.com>

* amber: Improved package.py and added version 18

- Added amber 18 with ambertools 19
- Added all available patches
- Added +update variant to use the self update
- Added +openmp variant to get openmp optomizations
- Added +x11 variant when possible
- Splitted amber 16 and 18 dependencies
- We now detect the copiler type and compile accordingly
- Added cray variant which is a bit special (untested)
- Improved detection of possible cuda versions
- All compilation optimizations +mpi +openmp +cuda are compatible
- Updated to use setup_build_environment(), setup_run_environment()

* amber: Adding missing flex and bison dependencies

* Removed cray variant; flex and bison now build only

* amber: Improved package.py and added version 18

- Added amber 18 with ambertools 19
- Added all available patches
- Added +update variant to use the self update
- Added +openmp variant to get openmp optomizations
- Added +x11 variant when possible
- Splitted amber 16 and 18 dependencies
- We now detect the copiler type and compile accordingly
- Added cray variant which is a bit special (untested)
- Improved detection of possible cuda versions
- All compilation optimizations +mpi +openmp +cuda are compatible
- Updated to use setup_build_environment(), setup_run_environment()

* amber: Adding missing flex and bison dependencies

* Removed cray variant; flex and bison now build only

* dealii: Fixed flake8 issues

* amber: corrected typo

* amber: Removed unused variant python
2019-12-02 16:01:14 -06:00
Jim Galarowicz
6d127e29de Fix conflict with respect to openssl and qt3 built for openspeedshop. (#13946)
* Fix conflict with respect to openssl and qt3 built for openspeedshop.

* Another fix because the first was incorrect.
2019-12-02 13:13:31 -06:00
Justin M Wozniak
543f37ea51 eq-r: Fix use of Executable.__call__() (#13952) 2019-12-02 13:13:05 -06:00
Adam J. Stewart
71eaffa46b Version bump: 1.13.1 (#13942) 2019-12-02 06:58:30 -08:00
Todd Gamblin
2dffbec486
git: add .gitattributes file (#13947)
Add a line to .gitattributes so that `git grep -p` shows function names
properly for `*.py` files.  Without this, the class name is shown instead
of the function for python files.

This also causes diff output to use proper functions as hunk headers in
`diff` output.

Here's an example with `git grep -p`.

Before:

    $ git grep -p spack_cc var/spack/repos/builtin/packages/athena
    var/spack/repos/builtin/packages/athena/package.py=class Athena(AutotoolsPackage):
    var/spack/repos/builtin/packages/athena/package.py:            env.set('CC', spack_cc)
    var/spack/repos/builtin/packages/athena/package.py:            env.set('LDR', spack_cc)

After:

    $ git grep -p spack_cc var/spack/repos/builtin/packages/athena
    var/spack/repos/builtin/packages/athena/package.py=    def setup_build_environment(self, env):
    var/spack/repos/builtin/packages/athena/package.py:            env.set('CC', spack_cc)
    var/spack/repos/builtin/packages/athena/package.py:            env.set('LDR', spack_cc)

Here's an example with `diff`.

Before:

    $ git show c5da94eb58
    [...]
    @@ -28,6 +29,7 @@ print(u'\\xc3')

             # make it executable
             fs.set_executable(script_name)
    +        filter_shebangs_in_directory('.', [script_name])

             # read the unicode back in and see whether things work
             script = ex.Executable('./%s' % script_name)

After:

    $ git show c5da94eb58
    [...]
    @@ -28,6 +29,7 @@ def test_read_unicode(tmpdir):

             # make it executable
             fs.set_executable(script_name)
    +        filter_shebangs_in_directory('.', [script_name])

             # read the unicode back in and see whether things work
             script = ex.Executable('./%s' % script_name)
2019-12-02 01:35:38 -08:00
Todd Gamblin
c36d9f297f
bugfix: mirror path works for unknown versions (#13626)
`mirror_archive_path` was failing to account for the case where the fetched version isn't known to Spack.

- [x] don't require the fetched version to be in `Package.versions`
- [x] add regression test for mirror paths when package does not have a version
2019-12-01 20:23:06 -08:00
Adam J. Stewart
b44df29316
environments: don't try to modify run-env if a spec is not installed (#13589)
Fixes #13529
Fixes #13509
2019-12-01 20:22:31 -08:00
Greg Becker
fba963f1d1
use semicolons instead of newlines in module/python command (#13904) 2019-12-01 20:21:34 -08:00
Daryl W. Grunau
9c5b583508
verify.py: os.path.exists exception handling (#13656) 2019-12-01 20:21:08 -08:00
Alexander Knieps
8e3ff9b39c dealii: Added 'threads' variant that controls the TBB dependency (#13931)
* dealii: Added 'threads' variant that controls the DEAL_II_WITH_THREADS cmake option and the dependency on Intel TBB

* Update var/spack/repos/builtin/packages/dealii/package.py

Co-Authored-By: Adam J. Stewart <ajstewart426@gmail.com>
2019-12-01 13:34:26 -06:00
Sergei Shudler
c7568c9146 Package/sensei: PR request for SENSEI (in situ analysis tool) recipe (#12973)
* Created an initial recipe for Sensei

* Cleanup syntax

* Small fixes for the Sensei recipe

* Cosmetic fixes to comply with PEP8

* More cosmetic fixes before PR

* Added more documentation before PR

* Fixed flake8 errors

* Fixes following PR review

* Fixes to pass Flake8 passes

* Some changes following PR review and support for SENSEI 3

* Update var/spack/repos/builtin/packages/sensei/package.py

Co-Authored-By: Axel Huebl <axel.huebl@plasma.ninja>

* Fixed Flake8 errors
2019-12-01 11:30:14 -06:00
Benjamin Fovet
fdd7a0e236 Add VTK version 8.2.0 (#13941) 2019-11-30 16:32:19 -06:00
jwallior
daaeb412a4 New python packages (#9974)
* New package: add py-jellyfish

* New package: add py-us

* New package: add py-xlwt

* New package: add py-svgpathtools

* New package: add py-svgwrite

* Change checksums to sha256

* Fix Copyright year.

* Add missing dependencies.
2019-11-30 16:32:02 -06:00
Benjamin Fovet
1c8a62aa86 Add package opencascade (#13938)
* Add new package : opencascade

* Remove boilerplate comment

* Fix flake8 errors

* Explicitly disable 3rd parties
2019-11-30 15:08:52 -06:00
Toyohisa Kameyama
c850e80bea cbtf: add rpcsvc-proto and libtirpc dependency. (#13798) 2019-11-30 13:08:24 -06:00
iarspider
aec5874b94 Mark py-argparse dependency everywhere with ^python@:2.6 (#13928)
* Mark py-argparse dependency everywhere with ^python@:2.6

* Update package.py

* Update package.py
2019-11-30 13:07:14 -06:00
Chris Green
c5da94eb58 Armor test script against shebang character limit if appropriate. (#12447) 2019-11-30 13:00:08 -06:00
darmac
46617b6f12 add new package : lshw (#13933)
* add new package : lshw

* update lshw package

* remove build methord
2019-11-30 01:13:23 -06:00
iarspider
94c8bf0322 Update Geant4 version and recipe (#13840)
* Update Geant4 version and recipe

According to the Geant4 developers, Geant4 supports Qt5 since at least 10.00.

* Update to new API
2019-11-29 16:21:51 -06:00
Adam J. Stewart
ab98ef1765
Mass conversion of setup_(dependent_)?environment (#13924)
* Mass conversion of setup_(dependent_)?environment

* prefix -> self.prefix
2019-11-29 15:00:44 -06:00
Mark W. Krentel
92ca639905 intel-tbb: fix and update patches for latest versions (#13932)
Commit 78724357 added versions 2019.5 to 2019.8 but failed to update
the patches for these versions.

1. gcc_generic-pedantic patch -- include this up through 2019.5.  This
was fixed in the TBB source tree in 2019.6.

2. tbb_cmakeConfig patch -- this needs to be modified (different file)
for 2019.5 and later.

3. tbb_gcc_rtm_key patch -- replace this with filter_file.  This is
simpler and eliminates the need to update the patch whenever the
surrounding context changes.
2019-11-29 13:18:56 -06:00
darmac
0f464b8d9f add new package : pipework (#13934) 2019-11-29 12:19:13 -06:00
darmac
e865856c84 add new package : qperf (#13935) 2019-11-29 12:18:41 -06:00
Peter Scheibel
cacfc3a6e1 Handle external perl (#13903)
* dont add perl bin directory to PATH when setting up env (this is already handled by spack core in a way that omits system dirs); also consolidate repeated logic between build/run env setup.

* the bin/ dir of each dependency is already added to PATH in Spack core, so there is no need to do this in the Perl package
2019-11-29 12:30:40 +01:00
iarspider
4dca63f007 Loosen restriction on setuptools version of py-backports-shutil-get-terminal-size: the bug seems to be fixed at least in setuptools 41.0.0 (#13927) 2019-11-28 11:54:01 -06:00
Tyler Reddy
008fe37941 BLD: enforce C++11 std for boost + xl_r (#13829)
* BLD: enforce C++11 std for boost + xl_r

* the spack `cxxstd` variant is not sufficient to enforce
`-std=c++11` usage in boost compile lines when `xl_r` compiler
spec is in use; while it would be nice if this were fixed
in a boost config file somewhere, for now this patch
allows boost to build on POWER9 with
an %xl_r compiler spec if the user specifies i.e.,:

`spack install boost@1.70.0+mpi cxxstd=11 %xl_r@16.1.1.5`

* Update var/spack/repos/builtin/packages/boost/package.py

Co-Authored-By: Adam J. Stewart <ajstewart426@gmail.com>
2019-11-27 23:08:54 -06:00
Glenn Johnson
e974f48be0 Build R without recommended packages (#12015)
The documentation states that Spack builds R without the recommmened
packages, with Spack handling the build of those packages to satisfy
dependencies. From the docs:

> Spack explicitly adds the --without-recommended-packages flag to
> prevent the installation of these packages. Due to the way Spack
> handles package activation (symlinking packages to the R installation
> directory), pre-existing recommended packages will cause conflicts for
> already-existing files. We could either not include these recommended
> packages in Spack and require them to be installed through
> --with-recommended-packages, or we could not install them with R and
> let users choose the version of the package they want to install. We
> chose the latter.

However, this is not what Spack is actually doing. The
`--without-recommended` configure option is not passed to R and
therefore those packages are built. This prevents R extension activation
from working as files in the recommended packages installed with R will
block linking of file from the respective `r-` packages.

This PR adds the `--without-recommended` flag to the configure options
of the R package. This will then have the Spack R build match what is
documented.
2019-11-27 20:58:12 -06:00
Justin S
1b24dfb8ba Replace git-based Bioconductor R packages (#12005)
* Replace git-based Bioconductor R packages

The current collection of bioconductor packages tend to have scattered
dependencies and missing versions. This commit replaces git-based
packages with tool-generated Spack package recipes with correct
dependencies and descriptions in place.

* Fix some broken package names, add periods to title docstrings

* r-clue: new package at 0.3-57

* r-genomeinfodbdata: add 1.2.1

* r-gofuncr: new package at 1.4.0

* r-pfam-db: add 3.8.2

* Add missed package r-genelendatabase

* update r-goseq package

* update r-glimma package

* update r-rots package

* r-org-hs-eg-db: add 3.8.2

* r-vgam: fix incorrect R version

* r-rnaseqmap: new package at 2.42.0

* r-rhdf5lib: new package at 1.6.0

* r-scrime: new package at 1.3.5

* r-delayedmatrixstats: new package at 1.6.0

* r-hdf5array: new package at 1.12.1

* r-biocfilecache: new package at 1.8.0

* r-ctc: add new versions, dependencies

* r-genemeta: new package at 1.56.0

* r-scrime: fix flake8

* r-ensembldb: add missing dependencies

* Added missing dependencies to packages with certain DESCRIPTIONS

* r-mapplots: new package at 1.5.1

* r-beachmat: new package at 2.0.0

* r-beeswarm: new package at 0.2.3

* r-biocneighbors: new package at 1.2.0

* r-biocsingular: new package at 1.0.0

* r-ecp: new package at 3.1.1

* r-enrichplot: new package at 1.4.0

* r-europepmc: new package at 0.3

* r-ggbeeswarm: new package at 0.6.0

* r-ggplotify: new package at 0.0.3

* r-ggraph: new package at 1.0.2

* r-gridgraphics: new package at 0.4-1

* r-rcppannoy: new package at 0.0.12

* r-rcpphnsw: new package at 0.1.0

* r-rsvd: new package at 1.0.1

* r-scater: new package at 1.12.2

* r-singlecellexperiment: new package at 1.6.0

* r-tximport: new package at 1.12.3

* r-upsetr: new package at 1.4.0

* r-vioplot: new package at 0.3.2

* r-readr: add 1.3.1

* r-matrixstats: add 0.54.0

* r-ecp: flake8 fix

* r-biocmanager: new package at 1.30.4

* update bioconductor packages requiring BiocManager, new versions

* r-lambda-r: add 1.2.3

* r-vegan: add 2.5-5

* r-cner, r-rcppannoy, r-reportingtools, r-rsvd: add missing newlines at EOF

* r-chemometrics: flake8 fixes

* r-vgam: flake8 fixes

* CRAN packages: use cloud.r-project.org

* Use DESCRIPTION for R version constraints over bioconductor releases

* Update missed packages ABAData, acde, affydata

* Update remaining missed packages

* bio: Drop 'when' clause from first checksummed versions

* bio: improve package description generation logic

* r-genomeinfodbdata: use explicit sha256 sums

* r-pfam-db: update dependencies, add 3.10.0

* update r-org-hs-eg-db

* r-dirichletmultinomial: re-add gsl

* r-polyclip: new package at 1.10-0

* r-farver: new package at 1.1.0

* r-tweenr: new package at 1.0.1

* r-ggforce: new package at 0.3.1

* r-ggforce: remove redundant dep

* r-ggraph: add missing deps

* r-rcpphnsw: remove redundant depends_on

* r-reportingtools: re-add r-r-utils dep

* r-rhdf5: add gmake dep

* r-rhtslib: add system dependencies

* r-rsamtools: add gmake dep

* r-farver: remove redundant dep

* r-tweenr: remove redundant dep

* r-variantannotation: add gmake dep

* r-rgraphviz: add graphviz dep

* r-vsn: correct r-hexbin constraint

* r-scater: fix obsolete deps

* r-variantannotation: fix gmake dep type

* r-scater: tighten R version constraints

* r-rsamtools: fix gmake dep type

* r-rhtslib: fix gmake dep type

* r-rhtslib: use xz over lzma

* r-rhdf5: fix gmake dep type

* r-farver: replace with newer recipe for 2.0.1

* r-mzr: remove old dependency

* r-reportingtools: remove builtin dependency

* r-mzr: add gmake dep

* r-rhtslib: make system libraries link deps

* r-genomeinfodbdata: fix R version constraints

* r-geoquery: remove old deps from new versions

* r-genomicfeatures: tighten r-rmysql dep

* r-ensembldb: tighten r-annotationhub dep

* r-complexheatmap: fix r-dendextend dep

* r-cner: fix utils dep name

* r-clusterprofiler: fix r-gosemsim version req

* r-biostrings: fix r-iranges version reqs

* r-rhdf5lib: add gmake dep

* r-oligoclasses: fix r-biocinstaller dep range

* r-organismdbi: fix r-biocinstaller dep range

* r-hdf5array: add gmake dep

* r-gtrellis: tighten r-circlize version req

* r-gostats: fix r-graph version req

* r-glimma: fix old dependency ranges

* r-biostrings: syntax fix

* r-organismdbi: syntax fix

* r-dose: fix r-igraph dep

* r-dose: fix r-scales, r-rvcheck deps

* r-affy: fix r-biocinstaller dep

* r-ampliqueso: fix homepage

* r-aneufinder: fix r-biocgenerics dep

* r-beachmat: fix changed deps

* r-biocneighbors: fix old R constraint

* r-biocmanager: rewrite recipe for 1.30.10

* Update var/spack/repos/builtin/packages/r-biocinstaller/package.py

Co-Authored-By: Adam J. Stewart <ajstewart426@gmail.com>

* Update var/spack/repos/builtin/packages/r-oligoclasses/package.py

Co-Authored-By: Adam J. Stewart <ajstewart426@gmail.com>
2019-11-27 20:57:15 -06:00
Rene Gassmoeller
0f46c3452f Add version 2.1.0 to 'aspect' package (#13830) 2019-11-27 20:04:00 -06:00
iarspider
6d7250f59c Update cartopy version and fix recipe (#13898)
* Update cartopy version and fix recipe

Cartopy 0.17.0 works fine with proj 6

* Update cartopy version and fix recipe

Cartopy 0.17.0 works fine with proj 6

* Set ACCEPT_USE_OF_DEPRECATED_PROJ_API_H flag when building extension

* Add variants to py-cartopy recipe as suggested

* Fix proj dependency

* Split dependency

* Fix PEP-8; remove extra dependency
2019-11-27 20:01:05 -06:00