This package was not setting FFTW when +mklfft was used with +cuda.
Since both were set to 'True', the default build was not linked to
any FFTW, leading to a run time error. It seems MKL support was
conflated with alternative CPU acceleration support. This PR does the
following:
- adds the altcpu variant to specify non-GPU/CPU acceleration
- sets a conflict between +altcpu and +cuda
- sets an FFTW implementation
- sets fltk+xft when +gui to get a decent looking GUI interface
- sets tbb dependency only when +altcpu
- adds dependency on ctffind
- adds variant and dependency on motioncor2
- sets defaults for
- qsub template location
- ctffind location
- motioncor2 location
Co-authored-by: Massimiliano Culpo <massimiliano.culpo@gmail.com>
1. Add version 2022.04.17 (new numbering scheme) and update mbuild resource.
2. Branch 'master' is now 'main'.
3. Old rev 10.2019.03 needs a patch for python vs python3.
* Add checksum for py-ipywidgets@7.7.0
* Correct py-widgetsnbextension and py-ipython dependencies
* Update widgetsnbextension dependency to 3.6
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
* Allow requirement to next versions
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
* Revert ipyhton dependencies
* Add widgetsnbextension@3.6.0 checksum
Co-authored-by: aandvalenzuela <andrea.valenzuela.ramirez@cern.ch>
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
* MAINT: Add a debug flag
* MAINT: Apply suggestions from code review
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
* openmpi: always require pmix for 4:
`~pmix` is not applicable to version 4+, since it always builds a vendored
copy of pmix (currently 3.2.3).
* pmix: relax version requirements
When the version range was specified, newer versions didn't exist.
Also use normalized spack versions rather than artificial .9.9 /.0.0.
* openmpi: restrict pmix versions
pmix option isn't available for OpenMPI@1, and according to
https://github.com/open-mpi/ompi/issues/7988 , OpenMPI 4.0.1 will not
build with pmix@3.1.5.
* pmix: add newer versions
* OpenMPI: re-express conflicts/configure logic as conditional variants
This relies partly on `self.enable_or_disable` and its ilk to emit an
empty list when the variant isn't applicable.
1. update for rocm 4.5 and drop support for earlier rocm.
2. no longer use mbedtls or gotcha, they are only for old revs.
3. update version requirements for dyninst and libmonitor
4. begin to deprecate old versions
