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Merge spack develop as of 2023/07/10 into jcsda_emc_spack_stack #295
Merge spack develop as of 2023/07/10 into jcsda_emc_spack_stack #295
Commits on Jun 22, 2023
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py-networkx: add 3.1 (spack#38377)
* py-networkx: add 3.1 * Update var/spack/repos/builtin/packages/py-networkx/package.py Co-authored-by: Adam J. Stewart <[email protected]> * Add default variant --------- Co-authored-by: Adam J. Stewart <[email protected]>
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hpx: Add conflict with some GCC versions and
+rocm
due to `valarray……` bug (spack#38297) * hpx: Add conflict with some GCC versions and +rocm due to valarray bug https://gcc.gnu.org/bugzilla/show_bug.cgi?id=103022 * remove conflict for %[email protected] since there is none --------- Co-authored-by: eugeneswalker <[email protected]>
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qt: new version 5.15.10 (spack#38489)
No changes to the build system, no changes to `package.py` needed. Changelog: qt/qtbase@v5.15.9-lts-lgpl...v5.15.10-lts-lgpl Main change taking up space: - bundled 3rdparty/pcre2 updated from 10.39 to 10.40 (spack now includes 10.42, and we don't put specific version requirements in `package.py`)
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py-platformdirs: add 3.5.3 (spack#38435)
* py-platformdirs: add 3.5.3 * py-typing-extensions: add 4.6.3
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open turns: Add libxml2 dependency and increase version to v1.20 (spa…
…ck#38038) * Add libxml2 dependency and increase version to v1.20 * Update var/spack/repos/builtin/packages/openturns/package.py Co-authored-by: Alec Scott <[email protected]> * Add v19 * Add libxml2 variant * Fix variant specification --------- Co-authored-by: Marc Schouler <[email protected]> Co-authored-by: Alec Scott <[email protected]>
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It installs the LFortran runtime library and LFortran can compile codes to binaries. The interactive mode does not work yet with LLVM > 11, that has to be fixed upstream. Co-authored-by: Wileam Y. Phan <[email protected]>
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py-notebook: add 6.5.4 (spack#38415)
* py-notebook: add 6.5.4 * [@spackbot] updating style on behalf of manuelakuhn * Update var/spack/repos/builtin/packages/py-notebook/package.py Co-authored-by: Adam J. Stewart <[email protected]> * Fix version of py-nbclassic dependency --------- Co-authored-by: Adam J. Stewart <[email protected]>
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freefem: add missing dependencies (spack#38290)
Also remove the custom `autoreconf` method as it does not seem to be necessary and potentially hides useful output provided by the default.
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VASP package: Zen4 Support (spack#36800)
* zen4 support for vasp * encourage openmp support in fftw/blas when +openmp * enable gamma and non-collinear builds
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rust: Add v1.70.0 and simplify package bootstrap (spack#38311)
* Add rust v1.70.0 and simplify package logic by moving bootstrap to dedicated package * Fix formatting of rust-bootstrap package file * Re-enable Rust as extendable * Add nightly version to rust and rust-bootstrap * Manually inject openssl certs into environment * Add master and beta versions to rust * Add additional documentation for using rust development releases * Remove @AndrewGaspar as maintainer
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* py-bcbio-gff: adding new version 0.7.0 * emblmygff3: adding new package * emblmygff3: adding py-setuptools dep
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Commits on Jun 23, 2023
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py-qmtest: add patch for the removed bdist_wininst class (spack#38253)
Co-authored-by: jmcarcell <[email protected]>
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spack buildcache sync (--manifest-glob <glob> | <src> <dest>) are mut…
…ually exclusive (spack#38533)
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Add recipe for iterative-stats (spack#38039)
* Add recipe for iterative-stats * Fix branch name and remove comment * Add git link * Add package maintainer * Enforce multiple requested changes * Update var/spack/repos/builtin/packages/py-iterative-stats/package.py Co-authored-by: Adam J. Stewart <[email protected]> * Update checksum * Fix openturns dependency specification * Add python variant spec to openturns --------- Co-authored-by: Marc Schouler <[email protected]> Co-authored-by: Adam J. Stewart <[email protected]>
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py-pytest: add 7.3.2 (spack#38522)
* py-pytest: add 7.3.2 * [@spackbot] updating style on behalf of manuelakuhn * Swap py-importlib-metadata dependency order * Restrict python version for older versions
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libEnsemble: add v0.10.0 (spack#37954)
* libEnsemble: add v0.10.0 * Make new deps required * Fixes to deps * Update var/spack/repos/builtin/packages/py-libensemble/package.py Co-authored-by: Adam J. Stewart <[email protected]> * Fix build, run * Reorder required deps --------- Co-authored-by: Adam J. Stewart <[email protected]>
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Commits on Jun 24, 2023
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range-v3: remove overbroad boost dependence (spack#38539)
Co-authored-by: greenc-FNAL <[email protected]>
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Fixes openmpi configure args for multinode execution on slurm (spack#…
…38403) Remove `--enable-mca-no-build=btl-uct` check for ucx spec as it is already fixed in the openmpi open-mpi/ompi#6666
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Fix syntax to set default target in aws-pcluster pipelines (spack#38048)
Co-authored-by: Massimiliano Culpo <[email protected]>
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GSI-ncdiag: add v1.1.0 and v1.1.1. (spack#38196)
Co-authored-by: [David Huber] <[[email protected]]>
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clp and osi depend on pkgconfig (spack#31505)
Co-authored-by: Massimiliano Culpo <[email protected]> Co-authored-by: Harmen Stoppels <[email protected]>
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gmap-gsnap: updating to 2023-06-01 (spack#38428)
Co-authored-by: LMS Bioinformatics <[email protected]>
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Commits on Jun 25, 2023
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ascent: add optional occa dep (spack#38426)
Co-authored-by: cyrush <[email protected]>
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Commits on Jun 26, 2023
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bzip2: add pkg-config file (spack#38355)
Co-authored-by: HongZhi He <[email protected]>
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py-scipy: add v1.11.0 (spack#38546)
Co-authored-by: adamjstewart <[email protected]>
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acts: ensure Python_EXECUTABLE uses ^python when +python (spack#38540)
By default, `find_package(Python)` searches from highest version to lowest version, identifying the highest version that satisfies the requirements. This means that `/usr/bin/python3.11` will be found before `$(spack location -i python)/bin/python3.10`, even when other packages have been built with the `python` in spack. This ensures that the `python` dependency is explicitly the `python` version that is used.
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Add raw attribute to env.set command (spack#38465)
Update `env.set` command and underlying `SetEnv` object to add the `raw` boolean attribute. `raw` is optional and set to False by default. When set to True, value format is skipped for object when generating environment modifications. With this change it is now possible to define environment variable whose value contains variable reference syntax (like `{foo}` or `{}`) that should be set as-is. Fixes spack#29578
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spectre: add v2023.06.19 (spack#38474)
Co-authored-by: sxs-bot <[email protected]>
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py-python-lzo: add 1.15 (spack#38418)
* py-python-lzo: add 1.15 * Update package.py --------- Co-authored-by: LMS Bioinformatics <[email protected]>
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mmseqs2: patching to support building with %gcc@13: (spack#38296)
Co-authored-by: LMS Bioinformatics <[email protected]>
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netcdf-c: apply patches (spack#38324)
* netcdf-c: fix building on macOS * netcdf-c: add patch fixing multi-threaded HDF5 calls * netcdf-c: update patch url
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cromwell: add v85 (spack#38427)
Co-authored-by: LMS Bioinformatics <[email protected]>
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llvm: fix build against libstdc++ 13 (spack#38329)
llvm @13-15 is required for ispc, but fails to build with GCC 13. 14.0.6 and 15.0.7 built successfully with upstream patch, 13.0.1 still fails. Thus upstream patch is applied to 14 and 15 only.
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Openfoam: replace two boolean variants with multi-valued variant for …
…precision option (spack#37736)
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Adds new Qthreads package version (spack#38421)
* Add new versions of Qthreads * Add version URLs explicitly as it has recently changed * Use function to extrapolate version URL for older versions * Fix url formatter
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modules: ignore more Modules variables in from_sourcing_file (spack#3…
…8455) Update list of excluded variables in `from_sourcing_file` function to cover all variables specific to Environment Modules or Lmod. Add specifically variables relative to the definition of `module()`, `ml()` and `_module_raw()` Bash functions. Fixes spack#13504
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krb5: add missing findutils dependency (spack#38440)
Co-authored-by: Massimiliano Culpo <[email protected]>
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Updates to symlinking for Windows (spack#34701)
* Support hardlinks/junctions on Windows systems without developer mode enabled * Generally, use of llnl.util.symlink.symlink is preferred over os.symlink since it handles this automatically * Generally an error is now reported if a user attempts to create a symlink to a file that does not exist (this was previously allowed on Linux/Mac). * One exception to this: when Spack installs files from the source into their final prefix, dangling symlinks are allowed (on Linux/Mac - Windows does not allow this in any circumstance). The intent behind this is to avoid generating failures for installations on Linux/Mac that were succeeding before. * Because Windows is strict about forbidding dangling symlinks, `traverse_tree` has been updated to skip creating symlinks if they would point to a file that is ignored. This check is not transitive (i.e., a symlink to a symlink to an ignored file would not be caught appropriately) * Relocate function: resolve_link_target_relative_to_the_link (this is not otherwise modified) Co-authored-by: jamessmillie <[email protected]>
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Commits on Jun 27, 2023
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CachedCMakePackage: set build type (spack#38502)
Fixed the cached CMake package so that the build_type field is saved in the cached configuration file.
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Revert "Updates to symlinking for Windows (spack#34701)" (spack#38578)
This reverts commit 66f7540.
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py-bx-python: add 0.9.0 (spack#38419)
* py-bx-python: add 0.9.0 * remove dependency * Remove python upper bound * Clarify dependency requirements --------- Co-authored-by: LMS Bioinformatics <[email protected]>
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tests/py-genshi: convert to new stand-alone test process (spack#38345)
* py-genshi: convert to new stand-alone test process * py-genshi: add run as py-setuptools deptype; remove test_testsuite comment
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Kokkos Kernels: adding release 3.7.1 and 4.0.0 (spack#36655)
Co-authored-by: eugeneswalker <[email protected]>
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py-lightning: add v2.0.4, drop +extra (spack#38531)
* py-lightning: add v2.0.4, drop +extra * Update dependencies
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kokkos-kernels: require kokkos+cuda_lambda (spack#38568)
(when +cuda, and on version 4.0.00 and up)
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py-rich: add 13.4.2, py-markdown-it-py: add 3.0.0, py-mdurl: new (spa…
…ck#38573) * py-rich: add 13.4.2, py-markdown-it-py: add 3.0.0, py-mdurl: add new package * Fix style
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HDF5: is_enabled helper (ON) (spack#35705)
* HDF5: is_enabled helper (ON) Slightly generalize the `is_enabled` helper in the HDF5 package. `ON` is the most typical CMake bool option passed, besides many other possible `true` values, and should be included as a possible check to the config. * Simplify --------- Co-authored-by: Tamara Dahlgren <[email protected]>
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py-ruamel-yaml: add 0.17.32 and py-ruamel-yaml-clib: add 0.2.7 (spack…
…#38585) * py-ruamel-yaml: add 0.17.32 and py-ruamel-yaml-clib: add 0.2.7 * Update var/spack/repos/builtin/packages/py-ruamel-yaml/package.py Co-authored-by: Adam J. Stewart <[email protected]> * Fix style * Fix python dependency --------- Co-authored-by: Adam J. Stewart <[email protected]>
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Commits on Jun 28, 2023
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Windows: Add PowerShell env support (spack#37951)
PowerShell requires explicit shell and env support in Spack. This is due to the distinct differences in shell interactions between cmd and pwsh. Add a doskey in pwsh piping 'spack' commands to a powershell script similar to the sh function 'spack'. Add support for PowerShell-specific shell interactions from Spack (set/unset shell variables).
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e4s ci: add hdf5-vol-daos (spack#37887)
* e4s ci: add hdf5-vol-daos * hdf5-vol-daos: comment with failure notes
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openblas: do not build tests when installing (spack#38591)
* openblas: do not build tests when installing * Add note about building tests
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py-pykerberos: needs krb5 for build to determine link and cflags via …
…krb5-config binary (spack#38623)
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Commits on Jun 29, 2023
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numaprof: New package (version : 1.1.4) (spack#35271)
* numaprof: New package (version : 1.1.4) * numaprof: Improve the deps description by adding 'type' * numaprof: Fix maintainer semantic
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CI: Disable building VisIt in CI (spack#38642)
VisIt requires a deprecated version of Python (3.7) due to a VTK 8 dependency. Spack CI does not support building deprecated versions.
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Commits on Jun 30, 2023
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py-nvidia-dali
: add v1.27.0 (spack#38605)* `py-nvidia-dali`: add v1.27.0 * Style
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py-iterative-stats: Change maintainer, add new version (spack#38609)
* Change maintainer, add new version and deprecate old one * Fix style issue * Revert deprecation --------- Co-authored-by: Marc Schouler <[email protected]>
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Py-shroud: add version 0.12.2 (spack#38643)
* add py-shroud version * change version number based on advice of adamjstewart
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gitlab ci: reorganize when we check for specs on mirrors (spack#38626)
Move the logic checking which mirrors have the specs we need closer to where that information is needed. Also update the staging summary to contain a brief description of why we scheduled or pruned each job. If a spec was found on any mirrors, regardless of whether we scheduled a job for it, print those mirrors.
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XZ package (Windows): install .dll files in bin (spack#35888)
Windows runtime library loading searches PATH, and therefore bin/ is the appropriate place to put .dll files. Prior to this change, XZ was installing both .dll and .lib files to the lib/ directory.
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Remove deprecated versions and packages (spack#37895)
This PR removes deprecated versions for all packages that I'm maintaining. In future Spack releases, I'm planning to do this on a much larger scale, but we can hold off until we have better reproducibility. I'm hoping that this will improve the maintainability of these packages. If any other maintainers of these recipes would like to retain any of these deprecated versions, or add new versions, speak now or forever hold your peace 😄 --------- Co-authored-by: adamjstewart <[email protected]>
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New package: pipx (spack#38658)
* py-userpath: new package * pipx: new package * Update var/spack/repos/builtin/packages/pipx/package.py Co-authored-by: Adam J. Stewart <[email protected]> * pipx: Remove incorrect dependency on py-platformdirs * Update var/spack/repos/builtin/packages/pipx/package.py Co-authored-by: Adam J. Stewart <[email protected]> * py-userpath: Remove version requirements to match upstream --------- Co-authored-by: Adam J. Stewart <[email protected]>
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Commits on Jul 1, 2023
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mercurial: add 6.x, fix python bounds (spack#38668)
* mercurial: add 6.x, fix python bounds * remove python@2 versions, cause package audits is complaining
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build(deps): bump docker/setup-buildx-action from 2.7.0 to 2.8.0 (spa…
…ck#38625) Bumps [docker/setup-buildx-action](https://github.com/docker/setup-buildx-action) from 2.7.0 to 2.8.0. - [Release notes](https://github.com/docker/setup-buildx-action/releases) - [Commits](docker/setup-buildx-action@ecf9528...16c0bc4) --- updated-dependencies: - dependency-name: docker/setup-buildx-action dependency-type: direct:production update-type: version-update:semver-minor ... Signed-off-by: dependabot[bot] <[email protected]> Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
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Commits on Jul 2, 2023
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Revert "openblas: do not build tests when installing (spack#38591)" (s…
…pack#38662) This reverts commit 51c75c6.
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Deprecate Python 3.7 (spack#38619)
* Deprecated Python 3.7 * Add Python 3.7.17 because why not
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Commits on Jul 3, 2023
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Add support to Paraview for TBB (spack#38582)
Co-authored-by: Jean Favre <[email protected]>
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dbus: AutotoolsPackage, optional documentation build (spack#38679)
Co-authored-by: Harmen Stoppels <[email protected]>
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add support for oneapi compiler to wrf 4.4 (spack#38607)
Signed-off-by: Andrey Parfenov <[email protected]>
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hdf5-vol-log: depends on mpi (spack#38693)
From the configure.ac file: > H5VL_log is built on top of MPI. Configure option --without-mpi or > --with-mpi=no should not be used. Abort. This currently fails to build in the oneAPI pipeline on `develop`
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ffmpeg
: patch build failure (spack#38656)* `ffmpeg`: patch build failure * [@spackbot] updating style on behalf of thomas-bouvier --------- Co-authored-by: thomas-bouvier <[email protected]>
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Commits on Jul 4, 2023
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plink2: add new package @2.00a4.3 (spack#38469)
Co-authored-by: LMS Bioinformatics <[email protected]>
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nvtx: add new package (spack#38430)
Co-authored-by: thomas-bouvier <[email protected]>
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gpi-space: add new versions (spack#38709)
Co-authored-by: Massimiliano Culpo <[email protected]>
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Commits on Jul 5, 2023
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Installations: don't set group permissions when they match what is de…
…sired (spack#38036) * When installing a package Spack will attempt to set group permissions on the install prefix even when the configuration does not specify a group. Co-authored-by: David Gomez <[email protected]>
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xrootd: add _STAT_VER patch (spack#38547)
Co-authored-by: jmcarcell <[email protected]>
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Build NAMD with Tcl by default (spack#38645)
NAMD users expect the Tcl scripting interface to be enabled as it is used in many examples and tutorials in addition to being required for features such as multi-copy algorithms.
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Update cosma and a few related recipes (spack#35615)
* Add maintainers * Updated cosma archive checksum and costa version - updated cosma version (in the cosma build system) - updated costa version - use the default generic url for downloading packages - do not build tiled-mm when the cpu only version is needed Signed-off-by: Dr. Mathieu Taillefumier <[email protected]> Co-authored-by: Rocco Meli <[email protected]> Co-authored-by: Harmen Stoppels <[email protected]>
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plumed: deprecate non-buildable versions, patch Python makefile only …
…when supported (spack#38713)
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salmon: patching to build with %gcc@13: (spack#38553)
Co-authored-by: LMS Bioinformatics <[email protected]>
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acts: new variant cxxstd (spack#38682)
* acts: allow ^root cxxstd=20 * acts: new variant cxxstd, pass through to root * acts: always args.append CMAKE_CXX_STANDARD from variant * acts: remove unused import * acts: fix self.define_from_variant
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py-spglib: add 2.0.2 (spack#38715)
* py-spglib: add 2.0.2 * Update var/spack/repos/builtin/packages/py-spglib/package.py Co-authored-by: Adam J. Stewart <[email protected]> * Remove py-setuptools as run dependency --------- Co-authored-by: Adam J. Stewart <[email protected]>
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perl: add 5.38.0, 5.36.1; prefer all even minor versions over develop…
…ment versions (spack#38690) * perl: add 5.38.0, 5.36.1; prefer all even minor versions over development versions * fix libxcrypt build with new perl * fix libxcrypt with a patch
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Commits on Jul 6, 2023
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py-pip: add 23.1.2 (spack#38608)
* py-pip: add 23.1.2 * Restrict py-pip version for py-protobuf * Restrict py-pip version for straightforward packages * Restrict py-pip version for nrm * Fix --install-option name in comments * Simplify py-pip restriction for py-scs * nrm: fix wrong comment
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py-dm-tree
: add v0.1.8 (spack#38606)* `py-dm-tree`: add v0.1.8 * Update dependencies * Fix hash
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[py-cymem] added version 2.0.7 (spack#38267)
* [py-cymem] added version 2.0.3 * [py-cymem] added restriction to py-wheel limitation
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py-abipy: add 0.9.3 (spack#38716)
* py-abipy: add 0.9.3 * Remove py-cython dependency * Remove dep version restrictions for new release
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[py-blis] added versions 0.7.9 and 0.9.1 (spack#38269)
* [py-blis] added version 0.7.9 * [py-blis] added version 0.9.1 * [py-blis] - removed type run for dependency py-cython
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openfoam.org: add a maintainer(spack#37280) (spack#37697)
Co-authored-by: Dom Heinzeller <[email protected]>
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Add new version 5.0.0 of PyAMG (spack#38674)
* Added v5.0.0 of PyAMG. This required v7.1.0 of setuptools_scm due to a bug in 7.0.5. * Added comment about version requirement. * Loosened dependency based on build experiments. * Updated tomli deps. * Update var/spack/repos/builtin/packages/py-setuptools-scm/package.py Dependence for 7.0 only. Co-authored-by: Adam J. Stewart <[email protected]> * Update var/spack/repos/builtin/packages/py-pyamg/package.py Co-authored-by: Adam J. Stewart <[email protected]> * Swapped lines. --------- Co-authored-by: Adam J. Stewart <[email protected]>
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mlpack: new package (spack#38277)
* mlpack: new package mlpack is an intuitive, fast, and flexible header-only C++ machine learning library with bindings to other languages. It is meant to be a machine learning analog to LAPACK, and aims to implement a wide array of machine learning methods and functions as a "swiss army knife" for machine learning researchers. * mlpack: upstream merged patch to allow python installation in spack
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Commits on Jul 7, 2023
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add info about spack env from spack-configs for oneAPI build tools (s…
…pack#38751) Signed-off-by: Andrey Parfenov <[email protected]>
Andrey Parfenov committedJul 7, 2023 Configuration menu - View commit details
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Fix multiple quadratic complexity issues in environments (spack#38771)
1. Fix O(n^2) iteration in `_get_overwrite_specs` 2. Early exit `get_by_hash` on full hash 3. Fix O(n^2) double lookup in `all_matching_specs` with hashes 4. Fix some legibility issues
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py-astropy: fix import tests and restrict py-pip version (spack#38731)
* py-astropy: fix import tests and restrict py-pip version * Fix --install-option name in comments * Rename variant and fix variant dependencies * Remove parquet variant from py-pyarrow
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New package: py-nanobind (spack#38327)
* initial commit of nanobind package * style fixes * Update package.py Typo * addressed PR comments * add v1.4.0 * Update var/spack/repos/builtin/packages/py-nanobind/package.py Co-authored-by: Adam J. Stewart <[email protected]> --------- Co-authored-by: Matthew Archer <[email protected]> Co-authored-by: Adam J. Stewart <[email protected]>
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py-matplotlib: add v3.7.2 (spack#38745)
* py-matplotlib: add v3.7.2 * Update dep versions
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py-pyarrow: disable dataset variant by default (spack#38775)
* py-pyarrow: enable parquet variant by default * Disable parquet variant by default * Add conflict to enable parquet when dataset is active * Disable dataset variant by default
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Commits on Jul 8, 2023
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qt-* (Qt6 pkgs): new versions 6.5.0, 6.5.1 (spack#36705)
* qt-base: new version 6.5.0 * qt-declarative: new version 6.5.0 * qt-quick3d: new version 6.5.0 * qt-quicktimeline: new version 6.5.0 * qt-shadertools: new version 6.5.0 * qt-*: new version 6.5.1 * qt-base: new version 6.5.1
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Commits on Jul 9, 2023
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Don’t call spec.format in Database._get_matching_spec_key (spack#38792)
`"%s" % spec` formats the spec with deps included, which produces sometimes KBs of data and is slow to run in pure Python. It can delay otherwise very short-lived read/write locks on the database. Discovered in spack#38762 where profile output showed about 2 seconds is spent in `spec.format`, which is significant overhead when using multiprocessing to install from binary cache in parallel (installation often takes <5s for small packages). With this change, `spec.format` no longer shows up in profile output. (This line hasn't changed since Spack v0.9 ;p) * move format() call to custom NoSuchSpecError exception * add a comment saying why, so we can eventually change `Spec.__str__`
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Automated deployment to update package flux-core 2023-07-08 (spack#38790
) Co-authored-by: github-actions <[email protected]>
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openssl: prefer 3.x (spack#36729)
* openssl: prefer 3.x This PR is not intended to be merged immediately, but it would be good to see what packages fail to build in CI so that we can get proper version constraints on openssl (before all packages update and support both openssl 1 and 3) * Disable assembly for 3.x %oneapi * cmake: depend on spack curl, to deal with curl - openssl compat * also make zlib external * remove overly strict & unsafe requirement on py-cryptographty patch version number * update openssl compat bounds in py-cryptography * smaller diff * Make libssh2 an autotools/cmake package * fix weird upperbound in libssh2 as there is not openssl v2 * libssh2: pc file lists plain -lssl -lcrypto w/o leading -L flag, confusing libgit2 parsing of pkg-config output * Actually fix the issue in libssh2: its pc file looks broken
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Commits on Jul 10, 2023
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Added package py-bitstruct (spack#38761)
* Added packages bitstruct, callmonitor, and PYnvtx * Revert "Added packages bitstruct, callmonitor, and PYnvtx" This reverts commit 76d25aa. * py-bitstruct: This module is intended to have a similar interface as the python struct module, but working on bits instead of primitive data types (char, int, …) * Update package.py To pass the style prechecks * PyNVTX: new package * Delete package.py Accidentally added this package. * Update var/spack/repos/builtin/packages/py-bitstruct/package.py Co-authored-by: Adam J. Stewart <[email protected]> --------- Co-authored-by: eugeneswalker <[email protected]> Co-authored-by: Adam J. Stewart <[email protected]>
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find: add
--hashes
shortcut for piping to other commands (spack#38663)People frequently ask us how to pipe `spack find` output to other commands, and we tell them to do things like this: ```console $ spack find --format "/{hash}" | spack uninstall -ay ``` Sometimes users don't know about hash references and come up with potentially ambiguous formulations like this: ```console spack find --format {name}@{version}%{compiler} | spack uninstall -ay ``` Since this is a common enough thing to want to do, and to make it more obvious how, this PR adds a `-H` / `--hashes` as a shortcut, so you can now just do: ```console spack find -H | spack uninstall -ay ```
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Update cp2k recipe to use cmake or the current build system (spack#35718
) * Update cp2k recipe to use cmake or the current build system Offers the possibility to build cp2k with the new cmake build system. commands like this are now supported spack install cp2k@master build_system=cmake +..... the recipe supports the following optional functionalities - superlu, cosma, sirius, spglib, metis, spglib, libxc, libint, cuda/rocm, mkl/openblas/sci (and others), mpi, openmp, dbcsr - dbcsr is built separately using the currently available recipe. Two PRs need to be merged to be fully functional (cosma update in spack + one PR in cp2k github). * Fix indentation * Fix indentation * Update libvori * More typos * Simplify BLAS/LAPACK * Simplify BLAS/LAPACK * Add A100 gpu value * Fix typo * Add the enable_regtests option if -DCP2K_ENABLE_REGTESTS=ON (+enable_regtests with spack) then the location of the binary executables will be in the cp2k root directory under exe/build-cmake-*. This option is needed to run the regtests afterwards. * Minor update * more fixes * Update var/spack/repos/builtin/packages/cp2k/package.py Co-authored-by: Mikael Simberg <[email protected]> * Update var/spack/repos/builtin/packages/cp2k/package.py Co-authored-by: Mikael Simberg <[email protected]> * Update var/spack/repos/builtin/packages/cp2k/package.py Co-authored-by: Mikael Simberg <[email protected]> * Update var/spack/repos/builtin/packages/cp2k/package.py Co-authored-by: Mikael Simberg <[email protected]> * Update var/spack/repos/builtin/packages/cp2k/package.py Co-authored-by: Mikael Simberg <[email protected]> * Update var/spack/repos/builtin/packages/cp2k/package.py Co-authored-by: Mikael Simberg <[email protected]> * small changes * Remove any reference to nvidia architecture in the rocm list * Update var/spack/repos/builtin/packages/cp2k/package.py Co-authored-by: Alberto Invernizzi <[email protected]> * Update var/spack/repos/builtin/packages/cp2k/package.py Co-authored-by: Alberto Invernizzi <[email protected]> * Update var/spack/repos/builtin/packages/cp2k/package.py Co-authored-by: Alberto Invernizzi <[email protected]> * Update var/spack/repos/builtin/packages/cp2k/package.py Co-authored-by: Alberto Invernizzi <[email protected]> * Update var/spack/repos/builtin/packages/cp2k/package.py Co-authored-by: Alberto Invernizzi <[email protected]> * Update var/spack/repos/builtin/packages/cp2k/package.py Co-authored-by: Alberto Invernizzi <[email protected]> * Final reformating * Update py-fypp --------- Co-authored-by: Mikael Simberg <[email protected]> Co-authored-by: Alberto Invernizzi <[email protected]>
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Commits on Jul 12, 2023
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Commits on Jul 14, 2023
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Commits on Jul 17, 2023
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Replace path with manifest_dir in lib/jcsda-emc/spack-stack/stack/sta…
…ck_env.py, remove init_file
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Update call to Environment class in lib/jcsda-emc/spack-stack/tests/t…
…est_setup_meta_modules.py
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Commits on Jul 19, 2023
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Update var/spack/repos/builtin/packages/bufr/package.py: Add dependen…
…cy on py-wheel, apply patch to fix Python version in install dir, remove extra py install step
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Commits on Jul 20, 2023
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Bug fix in lib/jcsda-emc/spack-stack/stack/meta_modules.py: on macOS,…
… recent spack versions use compiler version format @=x.y.z
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Commits on Jul 22, 2023
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Update static logic from var/spack/repos/builtin/packages/cmake/packa…
…ge.py, openssl is no longer a dependency for make
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Commits on Jul 31, 2023
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Commits on Aug 1, 2023
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Commits on Aug 7, 2023
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