Commit graph

29731 commits

Author SHA1 Message Date
Harmen Stoppels
db8f115013
Use urllib handler for s3:// and gs://, improve url_exists through HEAD requests (#34324)
* `url_exists` improvements (take 2)

Make `url_exists` do HEAD request for http/https/s3 protocols

Rework the opener: construct it once and only once, dynamically dispatch
to the right one based on config.
2022-12-10 00:20:29 +01:00
Manuela Kuhn
09b5476049
py-simplejson: add 3.18.0 (#34430) 2022-12-09 13:11:30 -07:00
Sinan
14c4896ec2
package/qt-base: add conflict for older gcc (#34420) 2022-12-09 12:47:29 -07:00
Ben Morgan
b5ef5c2eb5
geant4: version bumps for Geant4 11.1.0 release (#34428)
* geant4: version bumps for Geant4 11.1.0

- Version bumps for new data libraries
  - g4ndl 4.7
  - g4emlow 8.2
- Add geant4-data@11.1.0
- Checksum new Geant4 11.1.0 release
  - Limit +python variant to maximum of :11.0 due to removal of
    Geant4Py in 11.1
  - Update CLHEP dependency to at least 2.4.6.0 for this release
  - Update VecGeom dependency to at least 1.2.0 for this release,
    closing version ranges for older releases to prevent multiple
    versions satisfying requirement

* geant4: correct max version for python support
2022-12-09 12:26:22 -07:00
Scott Wittenburg
675afd884d
gitlab ci: more resources for paraview and py-torch (#34412) 2022-12-09 11:58:37 -07:00
shanedsnyder
0f5482dc9a
[darshan-runtime, darshan-util, py-darshan]: darshan 3.4.1 release updates (#34294) 2022-12-09 19:56:53 +01:00
Jen Herting
069e5f874c
New package: py-torchdiffeq (#34409)
* [py-torchdiffeq] new package

* [@spackbot] updating style on behalf of qwertos

Co-authored-by: qwertos <qwertos@users.noreply.github.com>
2022-12-09 12:38:14 -06:00
Manuela Kuhn
cad01a03cb
py-nbformat: add 5.7.0 and new package py-hatch-nodejs-version (#34361) 2022-12-09 12:32:41 -06:00
Manuela Kuhn
f10f8ed013
py-setupmeta: add 3.3.2 (#34421) 2022-12-09 12:32:19 -06:00
Todd Gamblin
d991ec90e3
new command: spack pkg grep to search package files (#34388)
It's very common for us to tell users to grep through the existing Spack packages to
find examples of what they want, and it's also very common for package developers to do
it. Now, searching packages is even easier.

`spack pkg grep` runs grep on all `package.py` files in repos known to Spack. It has no
special options other than the search string; all options passed to it are forwarded
along to `grep`.

```console
> spack pkg grep --help
usage: spack pkg grep [--help] ...

positional arguments:
  grep_args  arguments for grep

options:
  --help     show this help message and exit
```

```console
> spack pkg grep CMakePackage | head -3
/Users/gamblin2/src/spack/var/spack/repos/builtin/packages/3dtk/package.py:class _3dtk(CMakePackage):
/Users/gamblin2/src/spack/var/spack/repos/builtin/packages/abseil-cpp/package.py:class AbseilCpp(CMakePackage):
/Users/gamblin2/src/spack/var/spack/repos/builtin/packages/accfft/package.py:class Accfft(CMakePackage, CudaPackage):
```

```console
> spack pkg grep -Eho '(\S*)\(PythonPackage\)' | head -3
AwsParallelcluster(PythonPackage)
Awscli(PythonPackage)
Bueno(PythonPackage)
```

## Return Value

This retains the return value semantics of `grep`:
* 0  for found,
* 1  for not found
* >1 for error

## Choosing a `grep`

You can set the ``SPACK_GREP`` environment variable to choose the ``grep``
executable this command should use.
2022-12-09 10:07:54 -08:00
snehring
8353d1539f
py-torchvision: fix typo in version restriction for ffmpeg (#34415) 2022-12-09 11:05:43 -07:00
iarspider
bf3d18bf06
Add checksum for py-packaging11 0.12.3 (#34402) 2022-12-09 06:43:44 -07:00
John W. Parent
0e69710f41
Windows: reenable unit tests (#33385)
Unit tests on Windows are supposed to pass for any PR to pass CI.
However, the return code for the unit test command was not being
checked, which meant this check was always passing (effectively
disabled). This PR

* Properly checks the result of the unit tests and fails if the
  unit tests fail
* Fixes (or disables on Windows) a number of tests which have
  "drifted" out of support on Windows since this check was
  effectively disabled
2022-12-09 13:27:46 +00:00
Harmen Stoppels
ec62150ed7
binary distribution: warn about issues (#34152) 2022-12-09 13:25:32 +01:00
Massimiliano Culpo
d37dc37504
btop++: add new package (#34399) 2022-12-09 12:59:46 +01:00
iarspider
38d37897d4
Add checksum for py-onnxmltools 1.11.1 (#34400) 2022-12-09 04:04:20 -07:00
Todd Gamblin
606eef43bd
bugfix: spack load shell test can fail on macos (#34419)
At some point the `a` mock package became an `AutotoolsPackage`, and that means it
depends on `gnuconfig` on macOS. This was causing one of our shell tests to fail on
macOS because it was testing for `{a.prefix.bin}:{b.prefix.bin}` in `PATH`, but
`gnuconfig` shows up between them.

- [x] simplify the test to check `spack load --sh a` and `spack load --sh b` separately
2022-12-09 10:36:54 +00:00
Mikael Simberg
02a30f8d95
Add pika-algorithms package and pika 0.11.0 (#34397)
* Add 20 as a valid option for cxxstd to fmt

* Add pika 0.11.0

* Fix version constraint for p2300 variant in pika package

* Add pika-algorithms package
2022-12-09 11:26:48 +01:00
Harmen Stoppels
7e054cb7fc
s3: cache client instance (#34372) 2022-12-09 08:50:32 +01:00
Manuela Kuhn
d29cb87ecc
py-reportlab: add 3.6.12 (#34396)
* py-reportlab: add 3.6.12

* Update var/spack/repos/builtin/packages/py-reportlab/package.py

Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>

Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
2022-12-08 20:08:00 -06:00
Bernhard Kaindl
f8c0d9728d
intel-mkl: It is only available for x86_64 (#34391) 2022-12-08 18:10:00 -07:00
Bernhard Kaindl
f5bff16745
bcache: Fix check for libintl to work correctly (#34383) 2022-12-08 17:37:10 -07:00
Adam J. Stewart
2d1cb6d64a
bash: add v5.2, readline patches (#34301) 2022-12-08 13:46:21 -07:00
Peter Scheibel
c6e35da2c7
Cray manifest: automatically convert 'cray' platform to 'linux' (#34177)
* Automatically convert 'cray' platform to 'linux'
2022-12-08 11:28:06 -08:00
Manuela Kuhn
f1cd327186
py-rdflib: add 6.2.0 (#34394) 2022-12-08 13:07:26 -06:00
Victor Lopez Herrero
391ad8cec4
dlb: new package (#34211) 2022-12-08 05:57:48 -07:00
Larry Knox
2c668f4bfd
Update hdf5 vol async version (#34376)
* Add version hdf5-vol-async@1.4
2022-12-08 05:37:34 -07:00
Glenn Johnson
52fdae83f0
pixman: add libs property (#34281) 2022-12-08 06:34:49 +01:00
Michael Kuhn
0ea81affd1
py-torch: fix build with gcc@12: (#34352) 2022-12-08 06:31:00 +01:00
Brian Van Essen
ddc6e233c7
libxcrypt: building @:4.4.17 requires automake@1.14: 2022-12-08 03:17:28 +01:00
Jon Rood
7ee4499f2b
Add texinfo dependency for binutils through version 2.38. (#34173) 2022-12-08 03:08:37 +01:00
Marco De La Pierre
641adae961
Add recipe for singularity-hpc, py-spython (#34234)
* adding recipe for singularity-hpc - 1st go

* typo in singularity-hpc recipe

* singularity-hpc, spython recipes: added platform variant

* singularity-hpc, spython recipes: platform variant renamed to runtime

* style fix

* another style fix

* yet another style fix (why are they not reported altogether)

* singularity-hpc recipe: added Vanessa as maintainer

* singularity-hpc recipe: add podman variant

* singularity-hpc recipe: added variant for module system

* shpc recipe: add version for py-semver dependency

Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>

* py-spython recipe: no need to specify generic python dep for a python pkg

* py-spython: py-requests not needed

Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
2022-12-07 20:07:30 -06:00
John W. Parent
aed77efb9a
Windows: Prevent SameFileError when rpathing (#34332) 2022-12-07 16:58:44 -08:00
Massimiliano Culpo
ab6499ce1e
parser: refactor with coarser token granularity (#34151)
## Motivation

Our parser grew to be quite complex, with a 2-state lexer and logic in the parser
that has up to 5 levels of nested conditionals. In the future, to turn compilers into
proper dependencies, we'll have to increase the complexity further as we foresee
the need to add:
1. Edge attributes
2. Spec nesting

to the spec syntax (see https://github.com/spack/seps/pull/5 for an initial discussion of
those changes).  The main attempt here is thus to _simplify the existing code_ before
we start extending it later. We try to do that by adopting a different token granularity,
and by using more complex regexes for tokenization. This allow us to a have a "flatter"
encoding for the parser. i.e., it has fewer nested conditionals and a near-trivial lexer.

There are places, namely in `VERSION`, where we have to use negative lookahead judiciously
to avoid ambiguity.  Specifically, this parse is ambiguous without `(?!\s*=)` in `VERSION_RANGE`
and an extra final `\b` in `VERSION`:

```
@ 1.2.3     :        develop  # This is a version range 1.2.3:develop
@ 1.2.3     :        develop=foo  # This is a version range 1.2.3: followed by a key-value pair
```

## Differences with the previous parser

~There are currently 2 known differences with the previous parser, which have been added on purpose:~

- ~No spaces allowed after a sigil (e.g. `foo @ 1.2.3` is invalid while `foo @1.2.3` is valid)~
- ~`/<hash> @1.2.3` can be parsed as a concrete spec followed by an anonymous spec (before was invalid)~

~We can recover the previous behavior on both ones but, especially for the second one, it seems the current behavior in the PR is more consistent.~

The parser is currently 100% backward compatible.

## Error handling

Being based on more complex regexes, we can possibly improve error
handling by adding regexes for common issues and hint users on that.
I'll leave that for a following PR, but there's a stub for this approach in the PR.

## Performance

To be sure we don't add any performance penalty with this new encoding, I measured:
```console
$ spack python -m timeit -s "import spack.spec" -c "spack.spec.Spec(<spec>)"
```
for different specs on my machine:

* **Spack:** 0.20.0.dev0 (c9db4e50ba045f5697816187accaf2451cb1aae7)
* **Python:** 3.8.10
* **Platform:** linux-ubuntu20.04-icelake
* **Concretizer:** clingo

results are:

| Spec          | develop       | this PR |
| ------------- | ------------- | ------- |
| `trilinos`  |  28.9 usec | 13.1 usec |
| `trilinos @1.2.10:1.4.20,2.0.1`  | 131 usec  | 120 usec |
| `trilinos %gcc`  | 44.9 usec  | 20.9 usec |
| `trilinos +foo`  | 44.1 usec  | 21.3 usec |
| `trilinos foo=bar`  | 59.5 usec  | 25.6 usec |
| `trilinos foo=bar ^ mpich foo=baz`  | 120 usec  | 82.1 usec |

so this new parser seems to be consistently faster than the previous one.

## Modifications

In this PR we just substituted the Spec parser, which means:
- [x] Deleted in `spec.py` the `SpecParser` and `SpecLexer` classes. deleted `spack/parse.py`
- [x] Added a new parser in `spack/parser.py`
- [x] Hooked the new parser in all the places the previous one was used
- [x] Adapted unit tests in `test/spec_syntax.py`


## Possible future improvements

Random thoughts while working on the PR:
- Currently we transform hashes and files into specs during parsing. I think
we might want to introduce an additional step and parse special objects like
a `FileSpec` etc. in-between parsing and concretization.
2022-12-07 14:56:53 -08:00
Houjun Tang
412bec45aa
SW4: new package (#34252)
* sw4
* use h5z-zfp develop
* update for macos
* Update package.py

Co-authored-by: Houjun Tang <tang@Houjuns-MacBook-Pro.local>
2022-12-07 14:26:05 -07:00
Manuela Kuhn
c3dcd94ebc
py-numba: add 0.56.4 (#34362) 2022-12-07 14:18:45 -07:00
Hanqi Guo
cb8f642297
ftk: add 0.0.7.1 (#34146) 2022-12-07 22:13:46 +01:00
Manuela Kuhn
92f19c8491
py-pywavelets: add 1.4.1 (#34369)
* py-pywavelets: add 1.4.1

* Update var/spack/repos/builtin/packages/py-pywavelets/package.py

Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>

* Update var/spack/repos/builtin/packages/py-pywavelets/package.py

Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>

Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
2022-12-07 13:40:10 -07:00
iarspider
f3f8b31be5
XRootD: add checksum + patch for 5.5.1 (#34209)
* Update package.py
* Add full_index to patch URL
* Update var/spack/repos/builtin/packages/xrootd/package.py
* Restore list_url

Co-authored-by: Tamara Dahlgren <35777542+tldahlgren@users.noreply.github.com>
2022-12-07 12:06:38 -08:00
MatthewLieber
63cadf04ea
osu-micro-benchmarks: add v7.0.1 (#34221)
Co-authored-by: Matt Lieber <lieber.31@osu.edu>
2022-12-07 21:02:43 +01:00
eugeneswalker
541e75350f
libnrm: allow mpi other than mpich (#34232) 2022-12-07 11:57:13 -08:00
Stephen Sachs
8806e74419
[quantum-espresso] Parallel make fails for 6.{6,7} (#34238)
* [quantum-espresso] Parallel make fails for 6.{6,7}
  I run into a race condition in `make` with Intel compiler on icelake when building QE 6.6 and 6.7.
* Fix comment

Co-authored-by: Stephen Sachs <stesachs@amazon.com>
2022-12-07 11:52:12 -08:00
Sam Gillingham
381f8161b1
update kealib to 1.5.0 (#34237) 2022-12-07 11:49:41 -08:00
shanedsnyder
884123b7ce
darshan-util: fix location of input for darshan-util tests (#34245)
* fix location of input for darshan-util tests
  Darshan log file used for test input was removed from the Darshan
  repo after the 3.4.0 release. This commit adds logic to use a
  different log file as test input for later Darshan versions.
2022-12-07 11:48:55 -08:00
Eric Müller
35aa875762
meep: add new versions and additional variants incl. dependencies (#34242)
* libctl: add new version
  Change-Id: I16f91cfab198c66b60407ab5bb2cb3ebeac6bc19
* New package: libgdsii
  Change-Id: I34b52260ab68ecc857ddf8cc63b124adc2689a51
* New package: mpb
  Change-Id: I6fdf5321c33d6bdbcaa1569026139a8483a3bcf8
* meep: add new version and variants
  Change-Id: I0b60a9a4d9a329f7bde9027514467e17376e6a39
* meep: use with_or_without
  Change-Id: I05584cb13df8ee153ed385e77d367cb34e39777e
2022-12-07 11:44:26 -08:00
Sam Grayson
9b0e79fcab
Fix Apptainer (#34329)
* Fix Apptainer
* Add comments
2022-12-07 11:05:22 -08:00
kwryankrattiger
8ba0faa9ee
Paraview catalyst updates (#34364)
* LibCatalyst: Fix version of pre-release develop version
* ParaView: Requires libcatalyst@2:
* ParaView: Apply adios2 module no kit patch to 5.11

This patch is still pending in VTK and didn't make it into 5.11 as anticipated.
2022-12-07 10:27:47 -08:00
Bernhard Kaindl
d464185bba
bcache: support external gettext when libintl is in glibc (#34114)
* bcache: support external gettext when `libintl` is in glibc

Many glibc-based Linux systems don't have gettext's libintl because
libintl is included in the standard system's glibc (libc) itself.

When using `spack external find gettext` on those, packages like
`bcache` which unconditionally to link using `-lintl` fail to link
with -lintl.

Description of the fix:

The libs property of spack's gettext recipe returns the list of libs,
so when gettext provides libintl, use it. When not, there is no
separate liblint library and the libintl API is provided by glibc.

Tested with `spack external find gettext` on glibc-based Linux and
in musl-based Alpine Linux to make sure that when -lintl is really
needed, it is really used and nothing breaks.
2022-12-07 11:39:02 -05:00
G-Ragghianti
7f4d71252b
Package magma: cleaned up cmake config (#33766) 2022-12-07 16:30:20 +01:00
Matthias Wolf
7950311767
likwid: add a permission fixing script a la singularity (#33503) 2022-12-07 15:51:02 +01:00