Commit graph

22919 commits

Author SHA1 Message Date
Harmen Stoppels
fc96c49b0b
Add py-pot with patch (#25712) 2021-09-14 15:55:02 +02:00
Harmen Stoppels
ce790a89f2
reframe: set PYTHONPATH at runtime (#25842) 2021-09-14 15:54:14 +02:00
Valentin Volkl
1b633e1ca4
ocaml: add patch for clang@11: (#25886) 2021-09-14 09:34:57 +02:00
Ben Darwin
2ac9dc76c4
dcmtk: add v3.6.4, v3.6.5, v3.6.6 (#25923) 2021-09-14 09:22:48 +02:00
Weston Ortiz
d7c5aa46fe
trilinos: variant for libx11 (#25823) 2021-09-14 08:53:53 +02:00
Edward Hartnett
f6eb16982a
added new version of parallelio library (#25916) 2021-09-13 18:22:54 -06:00
David Beckingsale
be1c4bc563
Rename camp 'main' version (#25918) 2021-09-13 16:55:55 -06:00
Timothy Brown
998de97091
ESMF, NEMSIO and UFS-UTILS changes. (#25846)
* ESMF and NEMSIO changes.

- Updating ESMF to set the COMM correctly when using Intel oneapi.
- Explicitly setting the CMake MPI Fortran compiler for NEMSIO.

* Update UFS utils CMake to use MPI_<lang>_COMPILER.
2021-09-13 16:13:43 -06:00
Greg Becker
dad69e7d7c
Fix environment reading from lockfile to trust written hashes (#25879)
#22845 revealed a long-standing bug that had never been triggered before, because the
hashing algorithm had been stable for multiple years while the bug was in production. The
bug was that when reading a concretized environment, Spack did not properly read in the
build hashes associated with the specs in the environment. Those hashes were recomputed
(and as long as we didn't change the algorithm, were recomputed identically). Spack's
policy, though, is never to recompute a hash. Once something is installed, we respect its
metadata hash forever -- even if internally Spack changes the hashing method. Put
differently, once something is concretized, it has a concrete hash, and that's it -- forever.

When we changed the hashing algorithm for performance in #22845 we exposed the bug.
This PR fixes the bug at its source, but properly reading in the cached build hash attributes
associated with the specs. I've also renamed some variables in the Environment class
methods to make a mistake of this sort more difficult to make in the future.

* ensure environment build hashes are never recomputed
* add comment clarifying reattachment of env build hashes
* bump lockfile version and include specfile version in env meta
* Fix unit-test for v1 to v2 conversion

Co-authored-by: Massimiliano Culpo <massimiliano.culpo@gmail.com>
2021-09-13 15:25:48 -06:00
Satish Balay
9956841331
petsc, petsc4py: add version 3.15.4 (#25912) 2021-09-13 11:49:36 -07:00
Massimiliano Culpo
e9f1cfdaaf
Avoid hidden circular dependencies in spack.architecture (#25873)
* Refactor platform etc. to avoid circular dependencies

All the base classes in spack.architecture have been
moved to the corresponding specialized subpackages,
e.g. Platform is now defined within spack.platforms.

This resolves a circular dependency where spack.architecture
was both:
- Defining the base classes for spack.platforms, etc.
- Collecting derived classes from spack.platforms, etc.
Now it dopes only the latter.

* Move a few platform related functions to "spack.platforms"

* Removed spack.architecture.sys_type()

* Fixup for docs

* Rename Python modules according to review
2021-09-13 11:04:42 -07:00
Chuck Atkins
060582a21d
ci: Add ecp-data-vis-sdk CI pipeline (#22179)
* ci: Add a minimal subset of the ECP Data & Vis SDK CI pipeline

* ci: Expand the ECP Data & Vis SDK pipeline with more variants
2021-09-13 11:34:13 -06:00
Chuck Atkins
c392454125
Disable dvsdk variants (#25889)
* dvsdk: Turn off variants by default

This allows an install to more easily be explicit about which pieces to
turn on as more variants are added

* dvsdk: effectively disable the broken variants
2021-09-13 11:33:55 -06:00
Seth R. Johnson
fca81c2ac8
kokkos: fail gracefully on missing microarch (#25910)
Fall back on known parent microarches (as determined by spack's built-in
archspec knowledge). Clsoes spack/spack#25907 .
2021-09-13 11:07:14 -06:00
Tamara Dahlgren
bafd84e191
Switch http to https where latter exists (#25672)
* Switch http to https where latter exists
* Hopefully restore original permissions
* Add URL updates after include the -L curl option
* Manual corrections to select URL format strings
2021-09-13 09:21:35 -07:00
Desmond Orton
1e08f31e16
New Version: mothur@1.46.1 (#25850) 2021-09-13 10:20:22 -06:00
Seth R. Johnson
1da7839898
trilinos: add conflicts for fortran (#25911) 2021-09-13 16:51:38 +02:00
Harmen Stoppels
a4a22a6926
Add a master branch for gnuconfig (#25866) 2021-09-13 14:17:32 +02:00
Nic McDonald
ceb94bd6ae
Log4cxx add v0.12.0, convert to CMakePackage (#25875) 2021-09-13 05:17:08 -06:00
Tim Gymnich
b745e208a3
ravel: fix missing header file (#25906)
Co-authored-by: Massimiliano Culpo <massimiliano.culpo@gmail.com>
2021-09-13 04:49:42 -06:00
Harmen Stoppels
6a8383b2a7
Make sure perl doesn't run into recompile with fPIC linker errors (#25834) 2021-09-13 11:29:15 +02:00
Kelly (KT) Thompson
6210e694e1
draco: add v7.11.0 (#24631) 2021-09-13 11:16:57 +02:00
Adam J. Stewart
2f889b045c
py-kornia: add new package (#25844) 2021-09-13 11:10:19 +02:00
Daniel Arndt
bc3b90f6ac
Add SYCL build option to ArborX (#25736) 2021-09-13 11:09:51 +02:00
Harmen Stoppels
1f323d296d
py-glmnet: new package (#25711) 2021-09-13 11:07:59 +02:00
Mikael Simberg
819cd41ee4
hpx, kokkos: add consistent variants for C++ std (#25535)
* Add cuda_constexpr variant to Kokkos package
* Don't require nvcc_wrapper in Kokkos package when using Cray compiler
2021-09-13 10:43:20 +02:00
Axel Huebl
c0069210e2
HiPACE: Update openPMD dep, add v21.09 (#25698) 2021-09-13 10:28:08 +02:00
Tamara Dahlgren
a1d792af4c
Bugfix: Correct checksum's sha256 when retrieve from remote (#25831) 2021-09-13 08:08:00 +00:00
Glenn Johnson
b7e61a4b75
Tell gtk-doc where the XML catalog is (#25569)
* Tell gtk-doc where the XML catalog is

The gtk-doc configure script has an option for specifying the path to
the XML catalog. If this is not set the configure script will search
a defined set of directories for a catalog file and will set
`with_xml_catalog` based on that. Only if no system catalog is found will
the XML_CATALOG_FILES be looked at. In order to make sure that the spack
provided catalog is used, pass the `--with-xml-catalog` option.

* Use the property from docbook-xml
2021-09-13 09:57:04 +02:00
Mickaël Schoentgen
59832fb0ac
httpie: add v2.5.0 (#25888) 2021-09-13 09:41:02 +02:00
Tamara Dahlgren
5fa075f5b4
Bugfix: spack test debug requires Spack tty (#25897) 2021-09-13 08:57:16 +02:00
gpotter2
4573741baa
nmap: overhaul of the package recipe (#25656) 2021-09-13 08:24:02 +02:00
Xavier Delaruelle
e0d8f67f34
environment-modules: add version 5.0.0 (#25904)
Adapt configure arguments to only keep useful ones for this new major
release version.
2021-09-13 07:58:40 +02:00
Adam J. Stewart
0545f7d5cc
py-pandas: add v1.3.3 (#25905) 2021-09-13 07:57:56 +02:00
Stephen McDowell
3a9028427c
[docs] document official gfortran macOS precompiled binaries (#25818)
* document official gfortran macOS precompiled binaries

* compile without -vvv ;) {squash this}
2021-09-10 14:11:26 -05:00
Harmen Stoppels
729726d157
Remove dead code in installer (#24035)
Currently as part of installing a package, we lock a prefix, check if
it exists, and create it if not; the logic for creating the prefix
included a check for the existence of that prefix (and raised an
exception if it did), which was redundant.

This also includes removal of tests which were not verifying
anything (they pass with or without the modifications in this PR).
2021-09-10 11:32:46 -07:00
Scott Wittenburg
81962f100c
Pipelines: build kokkos-kernels on bigger instance (#25845) 2021-09-10 08:27:42 -07:00
bernhardkaindl
d54a692e09
openssh: Fix parallel install issue, add test suite (#25790)
- Parallel install was failing to generate a config file.
- OpenSSH has an extensive test suite, run it if requested.
- 'executables' wrongly had 'rsh', replaced the openssh tools.
2021-09-10 05:58:37 -06:00
Christoph Conrads
b12f38383c
SQLite: fix rtree, add version, make discoverable (#25554)
There are two ways to build SQLite: With the Autotools setup or the
so-called "amalgamation" which is a single large C file containing the
SQLite implementation. The amalgamation build is controlled by
pre-processor flags and the Spack setup was using an amalgamation
pre-processor flag for a feature that is controlled by an option of the
configure script. As a consequence, until now Spack has always built
SQLite with the rtree feature enabled.
2021-09-09 18:13:49 -06:00
Mark Abraham
9084ad69b4
Have GROMACS log files indicate spack was used (#25869)
Knowing that spack has patched the code and organized the build is potentially valuable information for GROMACS users and developers troubleshooting their builds.

PLUMED does further patches to GROMACS, so that is expressed directly also.
2021-09-09 16:38:31 -06:00
albestro
59d8031076
CUDA official GCC conflicts (#25054)
* update CUDA 11 / GCC compatibility range

* additional unofficial conflict

* minor changes to comments
2021-09-09 15:03:16 -07:00
Massimiliano Culpo
5fddd48f80
Refactor unit-tests in test/architecture.py (#25848)
Modifications:
- Export platforms from spack.platforms directly, so that client modules don't have to import submodules
- Use only plain imports in test/architecture.py
- Parametrized test in test/architecture.py and put most of the setup/teardown in fixtures
2021-09-09 09:34:47 -06:00
acastanedam
d8b95a496c
openssl: link system openssl.conf after installation (#25807)
Co-authored-by: Arcesio Castaneda Medina <arcesio.castaneda.medina@itwm.fraunhofer.de>
2021-09-09 15:15:53 +02:00
Raghu Raja
161f0d5045
libfabric: Adds v1.13.1 (#25827)
This commit adds the 1.13.1 release. There was an update to the release
tarball on 9/7/21, so using the latest sha256 sum here.
2021-09-09 04:10:57 -06:00
Nathan Hanford
d83f7110d5
specs: move to new spec.json format with build provenance (#22845)
This is a major rework of Spack's core core `spec.yaml` metadata format.  It moves from `spec.yaml` to `spec.json` for speed, and it changes the format in several ways. Specifically:

1. The spec format now has a `_meta` section with a version (now set to version `2`).  This will simplify major changes like this one in the future.
2. The node list in spec dictionaries is no longer keyed by name. Instead, it is a list of records with no required key. The name, hash, etc. are fields in the dictionary records like any other.
3. Dependencies can be keyed by any hash (`hash`, `full_hash`, `build_hash`).
4. `build_spec` provenance from #20262 is included in the spec format. This means that, for spliced specs, we preserve the *full* provenance of how to build, and we can reproduce a spliced spec from the original builds that produced it.

**NOTE**: Because we have switched the spec format, this PR changes Spack's hashing algorithm.  This means that after this commit, Spack will think a lot of things need rebuilds.

There are two major benefits this PR provides:
* The switch to JSON format speeds up Spack significantly, as Python's builtin JSON implementation is orders of magnitude faster than YAML. 
* The new Spec format will soon allow us to represent DAGs with potentially multiple versions of the same dependency -- e.g., for build dependencies or for compilers-as-dependencies.  This PR lays the necessary groundwork for those features.

The old `spec.yaml` format continues to be supported, but is now considered a legacy format, and Spack will opportunistically convert these to the new `spec.json` format.
2021-09-09 01:48:30 -07:00
Harmen Stoppels
edb1d75b1b
Add new package gnuconfig (#25849) 2021-09-09 02:13:43 -06:00
bernhardkaindl
ed9b38c8e3
Fix python/packages.py's config_vars for python2 packages (#25839)
Analysis mostly by me, fix updated after suggestion by Adam J. Steward

Co-authored-by: Bernhard Kaindl <bernhard.kaindl@ait.ac.at>
2021-09-09 01:25:55 -06:00
Adam J. Stewart
1a5891754a
py-torchmetrics: add v0.5.1 (#25855) 2021-09-09 01:19:45 -06:00
Esteban Pauli
d916d801f2
sina: new package (#25448)
* Added spackage to build Sina (https://github.com/LLNL/Sina).

* Improvements to sina/package.py

Made numerous simplifications and improvements to sina/package.py
based on PR feedback.

* Added licence info

* Added maintainers

* Changed maintainers to be Github IDs.
2021-09-08 20:56:37 -07:00
Dr. Christian Tacke
46d770b416
root: Add Version 6.24.06 (#25822) 2021-09-08 16:29:10 -07:00