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* selalib: add (sca)lapack dependency
* selalib: change when "-mpi" to "~mpi"
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Add hdf5 version 1.10.11.
Update version condition for adding h5pfc->h5fc symlink. File h5pfc
exists in versions 1.10.10 and 1.10.22.
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Bumps [black](https://github.com/psf/black) from 23.9.1 to 23.10.1.
- [Release notes](https://github.com/psf/black/releases)
- [Changelog](https://github.com/psf/black/blob/main/CHANGES.md)
- [Commits](https://github.com/psf/black/compare/23.9.1...23.10.1)
---
updated-dependencies:
- dependency-name: black
dependency-type: direct:production
update-type: version-update:semver-minor
...
Signed-off-by: dependabot[bot] <support@github.com>
Co-authored-by: dependabot[bot] <49699333+dependabot[bot]@users.noreply.github.com>
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Co-authored-by: Matt Lieber <lieber.31@osu.edu>
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* Load the script file during enviroment setup so that all the enviroment variables are set properly
* Patch csh/tcsh so that it uses spacks via env
* Update SHA for latest version
* Extend shebang to perl and fix up the regex
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Co-authored-by: nilsvu <nilsvu@users.noreply.github.com>
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Convince the language server it's really just a BinaryCacheIndex,
otherwise it defaults to thinking it's Singleton, and can't autocomplete
etc.
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Co-authored-by: jmcarcell <jmcarcell@users.noreply.github.com>
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ISPC had a bug in their lookup for NCurses, this was fixed upstream and
backported here.
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Co-authored-by: wdconinc <wdconinc@users.noreply.github.com>
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always defined (#40733)
* Fix an issue reported here:
https://github.com/spack/spack/pull/36154#issuecomment-1781854894
* [@spackbot] updating style on behalf of v-dobrev
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The code should be functonally equivalent to what it was before,
but now to avoid cycles by design we are using a "hidden"
feature of clingo
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* acts: new version from 28.1.0 to 30.3.1
* acts: new version 30.3.2
* acts: new variant +podio
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* Add liggght patched for newer compiler
Add C++ 17 support
Add Clang and Oneapi support
* Add maintainers
* Fix format in liggghts
* Fix maintainers before versions
Co-authored-by: Alec Scott <alec@bcs.sh>
* Fix style and user to usr
* Update package.py
---------
Co-authored-by: Alec Scott <alec@bcs.sh>
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* [add] py-moarchiving: new package
* py-moarchiving: update from review: description, variant default value is False, switch when and type
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Co-authored-by: LydDeb <lyderic.debusschere@eolen.com>
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* [add] py-generateds: new package
* py-generateds: Update from review
Co-authored-by: Manuela Kuhn <36827019+manuelakuhn@users.noreply.github.com>
* py-generateds: add versions 2.41.5, 2.42.1, 2.42.2, 2.43.1 and 2.43.2
---------
Co-authored-by: LydDeb <lyderic.debusschere@eolen.com>
Co-authored-by: Manuela Kuhn <36827019+manuelakuhn@users.noreply.github.com>
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Co-authored-by: Benjamin Meyers <bsmits@rit.edu>
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* py-bluepyemodel: new package with dependencies
* py-morphio: add MPI as dependency to avoid failing builds
* Formatting
* py-bluepyefe: no need to set NEURON_INIT_MPI
* py-morphio: unifurcation branch is ancient history
* py-bluepyopt: only set NEURON_INIT_MPI with +neuron
* py-efel: get rid of old version
* py-morph{-tool,io}: rename develop to master to match branch
* py-bluepyefe: unset PMI_RANK is also neuron-related
* py-bluepyopt: PMI_RANK is also neuron-related
* Implement review remarks
* py-morph-tool, py-neurom: small fixes
* py-morphio: reword dependencies
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Typically MSVC is detected via the VSWhere program. However, this may
not be available, or may be installed in an unpredictable location.
This PR adds an additional approach via Windows Registry queries to
determine VS install location root.
Additionally:
* Construct vs_install_paths after class-definition time (move it to
variable-access time).
* Skip over keys for which a user does not have read permissions
when performing searches (previously the presence of these keys
would have caused an error, regardless of whether they were
needed).
* Extend helper functionality with option for regex matching on
registry keys vs. exact string matching.
* Some internal refactoring: remove boolean parameters in some cases
where the function was always called with the same value
(e.g. `find_subkey`)
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* e4s ci: add exago +cuda, +rocm builds
* exago: rename 5-18-2022-snapshot to snapshot.5-18-2022
* disable exago +rocm for non-external rocm ci install
* note that hiop +rocm fails to find hip libraries when they are spack-installed
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(#39850)
.bat or .exe files can be considered executable on Windows. This PR
expands the regex for detectable packages to allow for the detection
of packages that vendor .bat wrappers (intel mpi for example).
Additional changes:
* Outside of Windows, when searching for executables `path_hints=None`
was used to indicate that default path hints should be provided,
and `[]` was taken to mean that no defaults should be chosen
(in that case, nothing is searched); behavior on Windows has
now been updated to match.
* Above logic for handling of `path_hints=[]` has also been extended
to library search (for both Linux and Windows).
* All exceptions for external packages were documented as timeout
errors: this commit adds a distinction for other types of errors
in warning messages to the user.
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Credits to @ChristianKniep for advocating the idea of OCI image layers
being identical to spack buildcache tarballs.
With this you can configure an OCI registry as a buildcache:
```console
$ spack mirror add my_registry oci://user/image # Dockerhub
$ spack mirror add my_registry oci://ghcr.io/haampie/spack-test # GHCR
$ spack mirror set --push --oci-username ... --oci-password ... my_registry # set login credentials
```
which should result in this config:
```yaml
mirrors:
my_registry:
url: oci://ghcr.io/haampie/spack-test
push:
access_pair: [<username>, <password>]
```
It can be used like any other registry
```
spack buildcache push my_registry [specs...]
```
It will upload the Spack tarballs in parallel, as well as manifest + config
files s.t. the binaries are compatible with `docker pull` or `skopeo copy`.
In fact, a base image can be added to get a _runnable_ image:
```console
$ spack buildcache push --base-image ubuntu:23.04 my_registry python
Pushed ... as [image]:python-3.11.2-65txfcpqbmpawclvtasuog4yzmxwaoia.spack
$ docker run --rm -it [image]:python-3.11.2-65txfcpqbmpawclvtasuog4yzmxwaoia.spack
```
which should really be a game changer for sharing binaries.
Further, all content-addressable blobs that are downloaded and verified
will be cached in Spack's download cache. This should make repeated
`push` commands faster, as well as `push` followed by a separate
`update-index` command.
An end to end example of how to use this in Github Actions is here:
**https://github.com/haampie/spack-oci-buildcache-example**
TODO:
- [x] Generate environment modifications in config so PATH is set up
- [x] Enrich config with Spack's `spec` json (this is allowed in the OCI specification)
- [x] When ^ is done, add logic to create an index in say `<image>:index` by fetching all config files (using OCI distribution discovery API)
- [x] Add logic to use object storage in an OCI registry in `spack install`.
- [x] Make the user pick the base image for generated OCI images.
- [x] Update buildcache install logic to deal with absolute paths in tarballs
- [x] Merge with `spack buildcache` command
- [x] Merge #37441 (included here)
- [x] Merge #39077 (included here)
- [x] #39187 + #39285
- [x] #39341
- [x] Not a blocker: #35737 fixes correctness run env for the generated container images
NOTE:
1. `oci://` is unfortunately taken, so it's being abused in this PR to mean "oci type mirror". `skopeo` uses `docker://` which I'd like to avoid, given that classical docker v1 registries are not supported.
2. this is currently `https`-only, given that basic auth is used to login. I _could_ be convinced to allow http, but I'd prefer not to, given that for a `spack buildcache push` command multiple domains can be involved (auth server, source of base image, destination registry). Right now, no urllib http handler is added, so redirects to https and auth servers with http urls will simply result in a hard failure.
CAVEATS:
1. Signing is not implemented in this PR. `gpg --clearsign` is not the nicest solution, since (a) the spec.json is merged into the image config, which must be valid json, and (b) it would be better to sign the manifest (referencing both config/spec file and tarball) using more conventional image signing tools
2. `spack.binary_distribution.push` is not yet implemented for the OCI buildcache, only `spack buildcache push` is. This is because I'd like to always push images + deps to the registry, so that it's `docker pull`-able, whereas in `spack ci` we really wanna push an individual package without its deps to say `pr-xyz`, while its deps reside in some `develop` buildcache.
3. The `push -j ...` flag only works for OCI buildcache, not for others
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* gromacs: default to external blas & lapack
* drop vendored lapack/blas altogether
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otherwise it detected pre-configured compilers in an potentially different way.
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* Fix cmake_args for spglib v2.1.0+
* Add option to build fortran interface in package spglib
* fix style as sugested by ci/prechecks/style
* Enable fortran variant from v1.16.4 as suggested
Co-authored-by: Rocco Meli <r.meli@bluemail.ch>
---------
Co-authored-by: Rocco Meli <r.meli@bluemail.ch>
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