Commit graph

33636 commits

Author SHA1 Message Date
Todd Gamblin
910190f55b
database: optimize query() by skipping unnecessary virtual checks (#40898)
Most queries will end up calling `spec.satisfies(query)` on everything in the DB, which
will cause Spack to ask whether the query spec is virtual if its name doesn't match the
target spec's. This can be expensive, because it can cause Spack to check if any new
virtuals showed up in *all* the packages it knows about. That can currently trigger
thousands of `stat()` calls.

We can avoid the virtual check for most successful queries if we consider that if there
*is* a match by name, the query spec *can't* be virtual. This PR adds an optimization to
the query loop to save any comparisons that would trigger a virtual check for last.

- [x] Add a `deferred` list to the `query()` loop.
- [x] First run through the `query()` loop *only* checks for name matches.
- [x] Query loop now returns early if there's a name match, skipping most `satisfies()` calls.
- [x] Second run through the `deferred()` list only runs if query spec is virtual.
- [x] Fix up handling of concrete specs.
- [x] Add test for querying virtuals in DB.
- [x] Avoid allocating deferred if not necessary.

---------

Co-authored-by: Harmen Stoppels <me@harmenstoppels.nl>
2023-11-07 01:00:37 +00:00
Harmen Stoppels
4ce80b95f3
spack compiler find --[no]-mixed-toolchain (#40902)
Currently there's some hacky logic in the AppleClang compiler that makes
it also accept `gfortran` as a fortran compiler if `flang` is not found.

This is guarded by `if sys.platform` checks s.t. it only applies to
Darwin.

But on Linux the feature of detecting mixed toolchains is highly
requested too, cause it's rather annoying to run into a failed build of
`openblas` after dozens of minutes of compiling its dependencies, just
because clang doesn't have a fortran compiler.

In particular in CI where the system compilers may change during system
updates, it's typically impossible to fix compilers in a hand-written
compilers.yaml config file: the config will almost certainly be outdated
sooner or later, and maintaining one config file per target machine and
writing logic to select the correct config is rather undesirable too.

---

This PR introduces a flag `spack compiler find --mixed-toolchain` that
fills out missing `fc` and `f77` entries in `clang` / `apple-clang` by
picking the best matching `gcc`.

It is enabled by default on macOS, but not on Linux, matching current
behavior of `spack compiler find`.

The "best matching gcc" logic and compiler path updates are identical to
how compiler path dictionaries are currently flattened "horizontally"
(per compiler id). This just adds logic to do the same "vertically"
(across different compiler ids).

So, with this change on Ubuntu 22.04:

```
$ spack compiler find --mixed-toolchain
==> Added 6 new compilers to /home/harmen/.spack/linux/compilers.yaml
    gcc@13.1.0  gcc@12.3.0  gcc@11.4.0  gcc@10.5.0  clang@16.0.0  clang@15.0.7
==> Compilers are defined in the following files:
    /home/harmen/.spack/linux/compilers.yaml

```

you finally get:

```
compilers:
- compiler:
    spec: clang@=15.0.7
    paths:
      cc: /usr/bin/clang
      cxx: /usr/bin/clang++
      f77: /usr/bin/gfortran
      fc: /usr/bin/gfortran
    flags: {}
    operating_system: ubuntu23.04
    target: x86_64
    modules: []
    environment: {}
    extra_rpaths: []
- compiler:
    spec: clang@=16.0.0
    paths:
      cc: /usr/bin/clang-16
      cxx: /usr/bin/clang++-16
      f77: /usr/bin/gfortran
      fc: /usr/bin/gfortran
    flags: {}
    operating_system: ubuntu23.04
    target: x86_64
    modules: []
    environment: {}
    extra_rpaths: []
```

The "best gcc" is automatically default system gcc, since it has no
suffixes / prefixes.
2023-11-06 15:17:31 -08:00
Sinan
8f1f9048ec
package/qgis: add latest ltr (#40752)
* package/qgis: add latest ltr

* fix bug

* [@spackbot] updating style on behalf of Sinan81

* make flake happy

---------

Co-authored-by: sbulut <sbulut@3vgeomatics.com>
Co-authored-by: Sinan81 <Sinan81@users.noreply.github.com>
2023-11-06 15:55:20 -07:00
Harmen Stoppels
e7372a54a1
docs: expand section about relocation, suggest padding (#40909) 2023-11-06 14:49:54 -08:00
Michael Kuhn
5074b7e922
Add support for aliases (#17229)
Add a new config section: `config:aliases`, which is a dictionary mapping aliases
to commands.

For instance:


```yaml
config:
    aliases:
        sp: spec -I
```

will define a new command `sp` that will execute `spec` with the `-I`
argument. 

Aliases cannot override existing commands, and this is ensured with a test.

We cannot currently alias subcommands. Spack will warn about any aliases
containing a space, but will not error, which leaves room for subcommand
aliases in the future.

---------

Co-authored-by: Todd Gamblin <tgamblin@llnl.gov>
2023-11-06 14:37:46 -08:00
Harmen Stoppels
461eb944bd
Don't let runtime env variables of compiler like deps leak into the build environment (#40916)
* Test that setup_run_environment changes to CC/CXX/FC/F77 are dropped in build env

* compilers set in run env shouldn't impact build

Adds `drop` to EnvironmentModifications courtesy of @haampie, and uses
it to clear modifications of CC, CXX, F77 and FC made by
`setup_{,dependent_}run_environment` routines when producing an
environment in BUILD context.

* comment / style

* comment

---------

Co-authored-by: Tom Scogland <scogland1@llnl.gov>
2023-11-06 14:30:27 -08:00
Harmen Stoppels
4700108b5b
fix prefix_inspections keys in example (#40904) 2023-11-06 13:22:13 -08:00
Harmen Stoppels
3384181868
docs: mention public build cache for GHA (#40908) 2023-11-06 13:21:16 -08:00
Vicente Bolea
f0f6e54b29
adios2: add v2.9.2 release (#40832) 2023-11-06 12:15:29 -08:00
Harmen Stoppels
a2f00886e9
defaults/modules.yaml: hide implicits (#40906) 2023-11-06 10:37:29 -08:00
Harmen Stoppels
1235084c20
Introduce default_args context manager (#39964)
This adds a rather trivial context manager that lets you deduplicate repeated
arguments in directives, e.g.

```python
depends_on("py-x@1", when="@1", type=("build", "run"))
depends_on("py-x@2", when="@2", type=("build", "run"))
depends_on("py-x@3", when="@3", type=("build", "run"))
depends_on("py-x@4", when="@4", type=("build", "run"))
```

can be condensed to

```python
with default_args(type=("build", "run")):
    depends_on("py-x@1", when="@1")
    depends_on("py-x@2", when="@2")
    depends_on("py-x@3", when="@3")
    depends_on("py-x@4", when="@4")
```

The advantage is it's clear for humans, the downside it's less clear for type checkers due to type erasure.
2023-11-06 10:22:29 -08:00
Greg Becker
b5538960c3
error messages: condition chaining (#40173)
Create chains of causation for error messages.

The current implementation is only completed for some of the many errors presented by the concretizer. The rest will need to be filled out over time, but this demonstrates the capability.

The basic idea is to associate conditions in the solver with one another in causal relationships, and to associate errors with the proximate causes of their facts in the condition graph. Then we can construct causal trees to explain errors, which will hopefully present users with useful information to avoid the error or report issues.

Technically, this is implemented as a secondary solve. The concretizer computes the optimal model, and if the optimal model contains an error, then a secondary solve computes causation information about the error(s) in the concretizer output.

Examples:

$ spack solve hdf5 ^cmake@3.0.1
==> Error: concretization failed for the following reasons:

   1. Cannot satisfy 'cmake@3.0.1'
   2. Cannot satisfy 'cmake@3.0.1'
        required because hdf5 ^cmake@3.0.1 requested from CLI 
   3. Cannot satisfy 'cmake@3.18:' and 'cmake@3.0.1
        required because hdf5 ^cmake@3.0.1 requested from CLI 
        required because hdf5 depends on cmake@3.18: when @1.13: 
          required because hdf5 ^cmake@3.0.1 requested from CLI 
   4. Cannot satisfy 'cmake@3.12:' and 'cmake@3.0.1
        required because hdf5 depends on cmake@3.12: 
          required because hdf5 ^cmake@3.0.1 requested from CLI 
        required because hdf5 ^cmake@3.0.1 requested from CLI

$ spack spec cmake ^curl~ldap   # <-- with curl configured non-buildable and an external with `+ldap`
==> Error: concretization failed for the following reasons:

   1. Attempted to use external for 'curl' which does not satisfy any configured external spec
   2. Attempted to build package curl which is not buildable and does not have a satisfying external
        attr('variant_value', 'curl', 'ldap', 'True') is an external constraint for curl which was not satisfied
   3. Attempted to build package curl which is not buildable and does not have a satisfying external
        attr('variant_value', 'curl', 'gssapi', 'True') is an external constraint for curl which was not satisfied
   4. Attempted to build package curl which is not buildable and does not have a satisfying external
        'curl+ldap' is an external constraint for curl which was not satisfied
        'curl~ldap' required
        required because cmake ^curl~ldap requested from CLI 

$ spack solve yambo+mpi ^hdf5~mpi
==> Error: concretization failed for the following reasons:

   1. 'hdf5' required multiple values for single-valued variant 'mpi'
   2. 'hdf5' required multiple values for single-valued variant 'mpi'
    Requested '~mpi' and '+mpi'
        required because yambo depends on hdf5+mpi when +mpi 
          required because yambo+mpi ^hdf5~mpi requested from CLI 
        required because yambo+mpi ^hdf5~mpi requested from CLI 
   3. 'hdf5' required multiple values for single-valued variant 'mpi'
    Requested '~mpi' and '+mpi'
        required because netcdf-c depends on hdf5+mpi when +mpi 
          required because netcdf-fortran depends on netcdf-c 
            required because yambo depends on netcdf-fortran 
              required because yambo+mpi ^hdf5~mpi requested from CLI 
          required because netcdf-fortran depends on netcdf-c@4.7.4: when @4.5.3: 
            required because yambo depends on netcdf-fortran 
              required because yambo+mpi ^hdf5~mpi requested from CLI 
          required because yambo depends on netcdf-c 
            required because yambo+mpi ^hdf5~mpi requested from CLI 
          required because yambo depends on netcdf-c+mpi when +mpi 
            required because yambo+mpi ^hdf5~mpi requested from CLI 
        required because yambo+mpi ^hdf5~mpi requested from CLI 

Future work:

In addition to fleshing out the causes of other errors, I would like to find a way to associate different components of the error messages with different causes. In this example it's pretty easy to infer which part is which, but I'm not confident that will always be the case. 

See the previous PR #34500 for discussion of how the condition chains are incomplete. In the future, we may need custom logic for individual attributes to associate some important choice rules with conditions such that clingo choices or other derivations can be part of the explanation.

---------

Co-authored-by: Massimiliano Culpo <massimiliano.culpo@gmail.com>
2023-11-06 09:55:21 -08:00
Michael Kuhn
d3d82e8d6b
c-blosc2: add v2.11.1 (#40889) 2023-11-06 09:48:42 -08:00
Tamara Dahlgren
17a9198c78
Environments: remove environments created with SpackYAMLErrors (#40878) 2023-11-06 18:48:28 +01:00
Juan Miguel Carceller
c6c689be28
pythia8: fix configure args (#40644)
Co-authored-by: jmcarcell <jmcarcell@users.noreply.github.com>
2023-11-06 09:33:23 -08:00
AMD Toolchain Support
ab563c09d2
enable threading in amdlibflame (#40852)
Co-authored-by: vkallesh <Vijay-teekinavar.Kallesh@amd.com>
2023-11-06 09:20:19 -08:00
Sergio Sánchez Ramírez
abdac36fd5
Add Python as build dependency of Julia (#40903) 2023-11-06 09:03:38 -07:00
Harmen Stoppels
b8a18f0a78
mpich: remove unnecessary tuples and upperbounds (#40899)
* mpich: remove unnecessary tuples

* remove redundant :3.3.99 upperbound
2023-11-06 07:58:50 -07:00
Wouter Deconinck
17656b2ea0
qt: new version 5.15.11 (#40884)
* qt: new version 5.15.11

* qt: open end patch for qtlocation when gcc-10:
2023-11-06 06:08:19 -07:00
Harmen Stoppels
3c641c8509
spack env activate: create & activate default environment without args (#40756)
This PR implements the concept of "default environment", which doesn't have to be
created explicitly. The aim is to lower the barrier for adopting environments.

To (create and) activate the default environment, run

```
$ spack env activate
```

This mimics the behavior of

```
$ cd
```

which brings you to your home directory.

This is not a breaking change, since `spack env activate` without arguments
currently errors. It is similar to the already existing `spack env activate --temp`
command which always creates an env in a temporary directory, the difference
is that the default environment is a managed / named environment named `default`.

The name `default` is not a reserved name, it's just that `spack env activate`
creates it for you if you don't have it already.

With this change, you can get started with environments faster:

```
$ spack env activate [--prompt]
$ spack install --add x y z
```

instead of

```
$ spack env create default
==> Created environment 'default in /Users/harmenstoppels/spack/var/spack/environments/default
==> You can activate this environment with:
==>   spack env activate default
$ spack env activate [--prompt] default 
$ spack install --add x y z
```

Notice that Spack supports switching (but not stacking) environments, so the
parallel with `cd` is pretty clear:

```
$ spack env activate named_env
$ spack env status
==> In environment named_env
$ spack env activate
$ spack env status
==> In environment default
```
2023-11-05 22:53:26 -08:00
Michael Kuhn
141c7de5d8
Add command and package suggestions (#40895)
* Add command suggestions

This adds suggestions of similar commands in case users mistype a
command. Before:
```
$ spack spack
==> Error: spack is not a recognized Spack command or extension command; check with `spack commands`.
```
After:
```
$ spack spack
==> Error: spack is not a recognized Spack command or extension command; check with `spack commands`.

Did you mean one of the following commands?
  spec
  patch
```

* Add package name suggestions

* Remove suggestion to run spack clean -m
2023-11-05 14:32:09 -08:00
Todd Gamblin
f6b23b4653
bugfix: compress aliases for first command in completion (#40890)
This completes to `spack concretize`:

```
spack conc<tab>
```

but this still gets hung up on the difference between `concretize` and `concretise`:

```
spack -e . conc<tab>
```

We were checking `"$COMP_CWORD" = 1`, which tracks the word on the command line
including any flags and their args, but we should track `"$COMP_CWORD_NO_FLAGS" = 1` to
figure out if the arg we're completing is the first real command.
2023-11-05 10:15:37 +00:00
Harmen Stoppels
4755b28398
Hidden modules: always append hash (#40868) 2023-11-05 08:56:11 +01:00
Tamara Dahlgren
c9dfb9b0fd
Environments: Add support for including definitions files (#33960)
This PR adds support for including separate definitions from `spack.yaml`.

Supporting the inclusion of files with definitions enables user to make
curated/standardized collections of packages that can re-used by others.
2023-11-05 00:47:06 -07:00
Veselin Dobrev
5a67c578b7
mfem: allow cuda/rocm builds with superlu-dist built without cuda/rocm (#40847) 2023-11-04 20:15:56 -05:00
Michael Kuhn
e47be18acb
c-blosc: add v1.21.5 (#40888) 2023-11-04 16:51:37 -07:00
Harmen Stoppels
6593d22c4e
spack.modules.commmon: pass spec to SetupContext (#40886)
Currently module globals aren't set before running
`setup_[dependent_]run_environment` to compute environment modifications
for module files. This commit fixes that.
2023-11-04 20:42:47 +00:00
Massimiliano Culpo
f51dad976e
hdf5-vol-async: better specify dependency condition (#40882) 2023-11-04 20:31:52 +01:00
Cameron Rutherford
ff8cd597e0
hiop: fix cuda constraints (#40875) 2023-11-04 13:09:59 -05:00
eugeneswalker
fd22d109a6
sundials +sycl: add cxxflags=-fsycl via flag_handler (#40845) 2023-11-04 08:55:19 -05:00
zv-io
88ee3a0fba
linux-headers: support multiple versions (#40877)
The download URL for linux-headers was hardcoded to 4.x;
we need to derive the correct URL from the version number.
2023-11-04 12:21:12 +01:00
Massimiliano Culpo
f50377de7f
environment: solve one spec per child process (#40876)
Looking at the memory profiles of concurrent solves
for environment with unify:false, it seems memory
is only ramping up.

This exchange in the potassco mailing list:
 https://sourceforge.net/p/potassco/mailman/potassco-users/thread/b55b5b8c2e8945409abb3fa3c935c27e%40lohn.at/#msg36517698

Seems to suggest that clingo doesn't release memory
until end of the application.

Since when unify:false we distribute work to processes,
here we give a maxtaskperchild=1, so we clean memory
after each solve.
2023-11-03 23:10:42 +00:00
Adam J. Stewart
8e96d3a051
GDAL: add v3.7.3 (#40865) 2023-11-03 22:59:52 +01:00
Richarda Butler
8fc1ba2d7a
Bugfix: propagation of multivalued variants (#39833)
Don't encourage use of default value if propagating a multivalued variant.
2023-11-03 12:09:39 -07:00
Massimiliano Culpo
668a5b45e5
clingo-bootstrap: force setuptools through variant (#40866) 2023-11-03 16:53:45 +01:00
Andrew W Elble
70171d6caf
squashfuse: remove url_for_version (#40862)
0.5.0 tarball now has the 'v' removed from the name
2023-11-03 10:34:25 -04:00
Thomas-Ulrich
0f1898c82a
xdmf3: fix compilation with hdf5@1.10 and above (#37551) 2023-11-03 14:23:49 +01:00
Massimiliano Culpo
db16335aec
ASP-based solver: fix for unsplittable providers (#40859)
Some providers must provide virtuals "together", i.e.
if they provide one virtual of a set, they must be the
providers also of the others.

There was a bug though, where we were not checking if
the other virtuals in the set were needed at all in
the DAG.

This commit fixes the bug.
2023-11-03 12:56:37 +01:00
Harmen Stoppels
3082ce6a22
oci parsing: make image name case insensitive (#40858) 2023-11-03 12:50:30 +01:00
George Young
fe0cf80e05
py-spython: updating to @0.3.1 (#40839)
* py-spython: updating to @0.3.1

* Adding `when=` for py-semver

---------

Co-authored-by: LMS Bioinformatics <bioinformatics@lms.mrc.ac.uk>
2023-11-03 05:07:58 -06:00
Thomas-Ulrich
a5e6097af7
fix typo in packaging guide (#40853) 2023-11-03 09:56:13 +01:00
eugeneswalker
d4a1618e07
tau: update 2.33 hash, add syscall variant (#40851)
Co-authored-by: wspear <wjspear@gmail.com>
2023-11-03 07:58:00 +01:00
Veselin Dobrev
48a21970d1
MFEM: add logic to find CUDA math-libs when using HPC SDK installation (#40815)
* mfem: add logic to find CUDA math-libs when using HPC SDK installation

* [@spackbot] updating style on behalf of v-dobrev
2023-11-02 20:19:11 -07:00
Martin Aumüller
864d47043c
qt-svg: new package for Qt6 SVG module (#40834)
enables loading of SVG icons by providing plugin used by qt-base
2023-11-02 17:05:54 -07:00
Martin Aumüller
c2af2bcac3
qt-*: add v6.5.3 & v6.6.0 (#40833) 2023-11-02 19:52:15 -04:00
Martin Aumüller
7c79c744b6
libtheora: fix build on macos (#40840)
* libtheora: regenerate Makefile.in during autoreconf

The patch to inhibit running of configure would exit autogen.sh so early
that it did not yet run autoconf/automake/...
Instead of patching autogen.sh, just pass -V as argument, as this is
passed on to configure and lets it just print its version instead of
configuring the build tree.

Also drop arguments from autogen.sh, as they are unused when configure
does not run.

* libtheora: fix build on macos

Apply upstream patches in order to avoid unresolved symbols during building of libtheoraenc.
These patches require re-running automake/autoconf/...

Error messages:
libtool: link: /Users/ma/git/spack/lib/spack/env/clang/clang -dynamiclib  -o .libs/libtheoraenc.1.dylib  .libs/apiwrapper.o .libs/fragment.o .libs/idct.o .libs/internal.o .libs/state.o .libs/quant.o .l
ibs/analyze.o .libs/fdct.o .libs/encfrag.o .libs/encapiwrapper.o .libs/encinfo.o .libs/encode.o .libs/enquant.o .libs/huffenc.o .libs/mathops.o .libs/mcenc.o .libs/rate.o .libs/tokenize.o   -L/opt/spac
k/darwin-sonoma-m1/apple-clang-15.0.0/libtheora-1.1.1-uflq3jvysewnrmlj5x5tvltst65ho3v4/lib -logg -lm  -Wl,-exported_symbols_list -Wl,/var/folders/zv/qr55pmd9065glf0mcltpx5bm000102/T/ma/spack-stage/spac
k-stage-libtheora-1.1.1-uflq3jvysewnrmlj5x5tvltst65ho3v4/spack-src/lib/theoraenc.exp   -install_name  /opt/spack/darwin-sonoma-m1/apple-clang-15.0.0/libtheora-1.1.1-uflq3jvysewnrmlj5x5tvltst65ho3v4/lib
/libtheoraenc.1.dylib -compatibility_version 3 -current_version 3.2
ld: warning: search path '/opt/spack/darwin-sonoma-m1/apple-clang-15.0.0/libtheora-1.1.1-uflq3jvysewnrmlj5x5tvltst65ho3v4/lib' not found
ld: Undefined symbols:
  _th_comment_add, referenced from:
      _theora_comment_add in apiwrapper.o
  _th_comment_add_tag, referenced from:
      _theora_comment_add_tag in apiwrapper.o
  _th_comment_clear, referenced from:
      _theora_comment_clear in apiwrapper.o
  _th_comment_init, referenced from:
      _theora_comment_init in apiwrapper.o
  _th_comment_query, referenced from:
      _theora_comment_query in apiwrapper.o
  _th_comment_query_count, referenced from:
      _theora_comment_query_count in apiwrapper.o

* libtheora: add git versions

stable as version name for theora-1.1 branch was chosen so that it sorts between 1.1.x and master

* libtheora: remove unused patch

thanks to @michaelkuhn for noticing
2023-11-03 00:08:22 +01:00
garylawson
94d143763e
Update Anaconda3 -- add version 2023.09-0 for x86_64, aarch64, and ppc64le (#40622)
* Add 2023.09-0 for x86_64, aarch64, and ppc64le
   extend the anaconda3 package.py to support aarch64 and ppc64le. 
   add the latest version of anaconda3 to each new platform, including the existing x86_64
* formatting
2023-11-02 16:42:44 -06:00
Vanessasaurus
6f9425c593
Automated deployment to update package flux-sched 2023-10-18 (#40596)
Co-authored-by: github-actions <github-actions@users.noreply.github.com>
Co-authored-by: Tom Scogland <scogland1@llnl.gov>
2023-11-02 13:16:39 -07:00
Nicolas Cornu
05953e4491
highfive: 2.8.0 (#40837)
Co-authored-by: Nicolas Cornu <me@alkino.fr>
2023-11-02 14:03:44 -06:00
Sergey Kosukhin
6b236f130c
eccodes: rename variant 'definitions' to 'extra_definitions' (#36186) 2023-11-02 13:28:31 -06:00