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* Adds the spack recipe for building the pynpm python package
* fix license header
* Update var/spack/repos/builtin/packages/py-pynpm/package.py
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
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Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
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* py-fastremap: new package @1.14.1
* py-pyqtgraph: new package @0.13.3
* py-roifile: new package @2024.1.10
* py-superqt: new package @0.6.1
* cellpose: new package @2.2.3
* Appeasing black ...
* Dropping the cuda variant
* Update var/spack/repos/builtin/packages/py-fastremap/package.py
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
* Adding python version dependency
* Update var/spack/repos/builtin/packages/py-pyqtgraph/package.py
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
* Update var/spack/repos/builtin/packages/py-pyqtgraph/package.py
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
* Update var/spack/repos/builtin/packages/py-roifile/package.py
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
* Update var/spack/repos/builtin/packages/py-superqt/package.py
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
* Adding missing dep & conflict
* Appeasing black
* Adding missing py- prefix for dep
* Switching over to py-pyqt6
* Switching over to py-pyqt6
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Co-authored-by: LMS Bioinformatics <bioinformatics@lms.mrc.ac.uk>
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
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* new builtin package: py-biobb-structure-checking
* Update var/spack/repos/builtin/packages/py-biobb-structure-checking/package.py
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
* dependencies are also build dependencies
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Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
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* new builtin package: py-biobb-io
* Update var/spack/repos/builtin/packages/py-biobb-io/package.py
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
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Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
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* new builtin package: py-biobb-gromacs
* Update var/spack/repos/builtin/packages/py-biobb-gromacs/package.py
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
* added setuptools dependency
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Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
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Co-authored-by: LMS Bioinformatics <bioinformatics@lms.mrc.ac.uk>
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* Bump up the version for rocm-6.0.2 release
* extend the patches that were created for apps for rocm-6.0.0 and rocm-6.0.2 releases
(but apply hipfft patch for only 6.0.0)
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This fixes bugs, performance issues, and removes no longer necessary code.
Short version:
1. Creating views from Python extensions would error if the Spack `opt` dir itself was in some symlinked directory. Use of `realpath` would expand those, and keying into `merge_map` would fail.
2. Creating views from Python extensions (and Python itself, potentially) could fail if the `bin/` dir contains symlinks pointing outside the package prefix -- Spack keyed into `merge_map[target_of_symlink]` incorrectly.
3. In the `python` package the `remove_files_from_view` function was broken after a breaking API change two years ago (#24355). However, the entire function body was redundant anyways, so solved it by removing it.
4. Notions of "global view" (i.e. python extensions being linked into Python's own prefix instead of into a view) are completely outdated, and removed. It used to be supported but was removed years ago.
5. Views for Python extension would _always_ copy non-symlinks in `./bin/*`, which is a big mistake, since all we care about is rewriting shebangs of scripts; we don't want to copy binaries. Now we first check if the file is executable, and then read two bytes to check if it has a shebang, and only if so, copy the entire file and patch up shebangs.
The bug fixes for (1) and (2) basically consist of getting rid of `realpath` entirely, and instead simply keep track of file identifiers of files that are copied/modified in the view. Only after patching up regular files do we iterate over symlinks and check if they target one of those. If so, retarget it to the modified file in the view.
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Co-authored-by: James Beal <jb23@sanger.ac.uk>
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--with-ch4-max-vcis=default is no longer accepted by MPICH configure
since the 4.1 release. Just omit the option from the +vci variant, since
configure will select the default value in its absence.
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Problem: Older versions of the flux-core package require czmq and
jsonschema, but these dependencies have been dropped in recent
versions.
Add `when=` arguments to drop these requirements for the appropriate
versions of flux-core.
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* lammps: correct license
LAMMPS has always been GPL-2.0 only. The clarification was made here:
https://github.com/lammps/lammps/commit/9a8ac23663027f319c98ed4a08d4cda55faec606
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Co-authored-by: sbulut <sbulut@3vgeomatics.com>
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Co-authored-by: m-shunji <m.shunji@fujitsu.com>
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* fix wrong versioning
use doc version and not the one extrapolated from the path (i.e. 0.2.0.1)
* nvpl-lapack requires nvpl-blas
propagate matching variants to nvpl-blas dependency
Co-authored-by: albestro <albestro@users.noreply.github.com>
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* py-immutables: fix building, add new versions
* Explain constraint
* py-immutables: Wrap line
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* Deprecate FEniCSx packages
* Format files
* Simplification
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* py-configargparse: add new versions
* py-configargparse: Remove unnecessary constraint
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