Commit graph

13220 commits

Author SHA1 Message Date
Christoph Junghans
0d35ae7f5f gromacs: add v2019.4 and others (#13617)
* gromacs: add v2019.4 and others

* gromacs: fix patch applying
2019-11-06 13:24:14 -06:00
Andreas Baumbach
52afcfac4d new package: py-dateparser (#13574)
* new package: py-dateparser

* take setup.py dependencies into account

* fixup help->description

* reorder dependencies

* drop version constraints not enforced in setup.py
2019-11-06 13:18:37 -06:00
Andreas Baumbach
6b7a51587b new package: py-nodeenv (#13594)
* new package: py-nodeenv

* drop python version requirements, not enforced by setup.py
2019-11-06 13:16:49 -06:00
Andreas Baumbach
4ed56573c4 py-tatsu: new package (#13566)
* py-tatsu: new package

* drop unnecessary dependencies

* drop kanji, add variant, and restrict to future releases
2019-11-06 13:16:05 -06:00
Michael Kuhn
52eba8fb00 netcdf-fortran: Fix parallel builds (#13612)
netcdf-fortran@4.5: will error if netcdf-c has been built with MPI
support:
```
configure: error:
      -----------------------------------------------------------------------
        The NetCDF C library is built with parallel I/O feature enabled, but
        the Fortran compiler '.../lib/spack/env/gcc/gfortran' supplied in this configure command
        does not support MPI-IO. Please use one that does. If parallel I/O
        feature is not desired, please use a NetCDF C library with parallel
	I/O feature disabled. Abort.
      -----------------------------------------------------------------------
```

Copy logic from netcdf-c to add an `mpi` variant.
2019-11-06 11:14:35 -06:00
Michael Kuhn
95bc677445 cdo: Fix with_or_without calls (#13614)
netcdf has been renamed to netcdf-c and udunits2 has been renamed to
udunits.
2019-11-06 11:13:21 -06:00
Andreas Baumbach
e292bef411 new package: py-pymeeus (#13572)
* new package: py-pymeeus

* drop unnecessary dependencies
2019-11-06 11:02:19 -06:00
Andreas Baumbach
ea5c7917ac new package: py-pre-commit (#13570)
* new package: py-pre-commit

* update missing dependencies

* add python version restriction
2019-11-06 11:01:33 -06:00
Andreas Baumbach
2bd1a0ca4c new package: py-aspy-yaml (#13591)
* new package: py-aspy-yaml

* add python version dependency
2019-11-06 10:55:19 -06:00
Michael Kuhn
abce878fad go: Add 1.13.4 and 1.12.13 (#13609) 2019-11-06 11:36:35 +01:00
Axel Huebl
f9dc41f806 pybind11: correct get_include path (#13605)
* pybind11: test get_include path

Helper for non-CMake downstream projects to find the pybind11
header location.

* pybind11: return proper get_include()

use our prefix instead of letting pybind11 trying to self-determine
it from given conda/virtualenv/global rules.

Co-Authored-By: Adam J. Stewart <ajstewart426@gmail.com>
2019-11-06 07:15:13 +01:00
Andreas Baumbach
a684efe826 new package: py-ics (#13576)
* new package: py-ics

* drop 0.5 and move to tar-ball

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

Co-Authored-By: Adam J. Stewart <ajstewart426@gmail.com>

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

Co-Authored-By: Adam J. Stewart <ajstewart426@gmail.com>
2019-11-05 17:03:31 -06:00
Jordan Ogas
6dabdb7a82 add charliecloud 0.12 (#13599)
* add charliecloud 0.12

* fix typo

Co-Authored-By: Adam J. Stewart <ajstewart426@gmail.com>
2019-11-05 15:51:02 -06:00
Adam J. Stewart
6ffbc9c091
Add GDAL 3.0.2 (#13603) 2019-11-05 15:05:36 -06:00
Axel Huebl
8cbea5f767 mpi4py 3.0.3 (#13601)
* mpi4py 3.0.3

Adds support for Python 3.8 with new Cython files.
I tried to build 3.0.0 with Python 3.8 and this builds as well,
therefor I added no conflict.

* mpi4py: update dependency version ranges
2019-11-05 15:04:49 -06:00
Christoph Junghans
7c018bc2c8
netcdf: fix headers in v4.7.2 (#13600) 2019-11-05 12:56:02 -07:00
Christoph Junghans
10f509b182
elpa: add v 2019.05.002 (#13602) 2019-11-05 12:55:51 -07:00
Adam J. Stewart
27ab045dc1
PyTorch: avoid use of third party vendored deps (#13588)
* PyTorch: avoid use of third party vendored deps

* Flake8 fix
2019-11-05 13:19:07 -06:00
Andreas Baumbach
7a0bed7893 add depends_on(python) to PythonPackage stub (#13595) 2019-11-05 13:18:17 -06:00
Andreas Baumbach
68a34a11bc new package: py-nose-cov (#13571)
* new package: py-nose-cov

* add missing dependencies
2019-11-05 12:57:31 -06:00
Andreas Baumbach
74c81c0fc3 update py-notebook (#13423)
* update py-jupyter-notebook

* add setuptools dependency for newer version
  the whole jupyter collection seems to use setuptools in case of
  certain setup.py-arguments from the very beginning. However the latest
  ones actually require it, otherwise the build will fail
* add newly introduced dependencies

* dependency constraints

* drop terminal variant and update python dep
2019-11-05 12:51:00 -06:00
Andreas Baumbach
35f0003c08 new package py-cfgv (#13592) 2019-11-05 12:47:52 -06:00
Andreas Baumbach
aa2972172a new package: py-identify (#13593) 2019-11-05 12:46:57 -06:00
Douglas Duckworth
54e1d57647 added relion 3.0.8 [latest stable version in 3.0 branch] as well as 3.1_beta (#13539)
* added relion 3.0.8 [latest stable version in 3.0 branch] as well as 3.1_beta

* relion 3.1 beta compiles without Benchmarking build type see https://github.com/3dem/relion/issues/533

* relion 3.0.X - 3.1 now supports latest cmake@3
2019-11-05 12:40:27 -06:00
Todd Gamblin
a6ccb5b2fa
bugfix: uninstall should find concrete specs by DAG hash (#13598)
This fixes a regression introduced in #10792.  `spack uninstall` in an
environment would not match concrete query specs properly after the index
hash of enviroments changed.

- [x] Search by DAG hash for specs to remove instead of by build hash
2019-11-05 06:12:12 -07:00
Todd Gamblin
b77974e986
spack find now displays variants and other spec constraints (#13596)
If you do this in a spack environment:

    spack add hdf5+hl

hdf5+hl will be the root added to the `spack.yaml` file, and you should
really expect `hdf5+hl` to display as a root in the environment.

- [x] Add decoration to roots so that you can see the details about what
      is required to build.
- [x] Add a test.
2019-11-05 05:39:56 -07:00
Andreas Baumbach
527d639b0e new package py-testpath (#13417)
* new package py-testpath

dependency of py-nbconvert

* py-testpath: fix flake8

* Remove the unnecessary pip dependency
2019-11-04 19:39:25 -06:00
Andreas Baumbach
4f5d3770c7 update py-pyzmq (#13420)
* update py-zmq

* update dependencies
2019-11-04 19:38:19 -06:00
Andreas Baumbach
0341c38dff update py-jupyter-client and new setuptools dependency (#13425)
* update py-jupyter-client and new setuptools dependency

* update dependencies
2019-11-04 19:28:59 -06:00
xfzhao
18243695c9 Mothur update (#13580)
* add +vserach option

* fixes #967
2019-11-04 19:27:13 -06:00
Gregory Lee
7e2e93b787 added archer 2.0.0 and package build fixes (#13577) 2019-11-04 17:39:16 -06:00
Christoph Junghans
dd7ebcf2d9
portage: fix lapack/blas linkage (#13558) 2019-11-04 16:35:28 -07:00
Andreas Baumbach
0f3ffad430 py-colorama: new version 0.4.1 (#13562)
* py-colorama: new version 0.4.1

* add python dependency
2019-11-04 16:46:29 -06:00
Andreas Baumbach
0b93e95049 py-regex: new version 2019.11.1, w/o setuptools (#13563) 2019-11-04 16:45:47 -06:00
Andreas Baumbach
80f63f7f9b py-dataclasses: new package (#13564) 2019-11-04 16:44:11 -06:00
Andreas Baumbach
6b27d87e7a py-tzlocal: add new version 2.0.0 (#13565) 2019-11-04 16:43:15 -06:00
Andreas Baumbach
3bd7d7f211 new package: py-chai (#13567) 2019-11-04 16:41:28 -06:00
Andreas Baumbach
880a8d40ce new package: py-umalqurra (#13568) 2019-11-04 16:40:06 -06:00
Hadrien G
1114ae9375 Add ACTS v0.10.5 (#13556) 2019-11-04 11:43:45 -06:00
Sinan
bbb5284b42 py-astor: specify py-setuptools versions as build fail with latest version (#13533)
* specify py-setuptools dependency as build fail with latest version

* explain

* py-astor builds with setuptools@41.3
2019-11-04 10:21:59 -06:00
Stephen Herbein
19410461b7 Flux v0.11.1 - v0.11.3 (#13199)
* flux: add `url_for_version` to support their C4 repo model

Flux uses a fork of ZeroMQ's Collective Code Construction Contract
(https://github.com/flux-framework/rfc/blob/master/spec_1.adoc).
This model requires a repository fork for every stable release that has
patch releases.  For example, 0.8.0 and 0.9.0 are both tags within the
main repository, but 0.8.1 and 0.9.5 would be releases on the v0.8 and
v0.9 forks, respectively.

* flux: add latest versions

* flux: remove master from `when=@0.X:,master` statements

Now that #1983 has been merged, master > 0.X.0.

* flux-core: remove extraneous `99` patch version in `when` range

Replace `when=@:0.11.99` with `when=@:0.11` since the intention is to
include all patch versions of `0.11`.

* flux-core: fix `setup_build_environment` after changes in #13411

In #13411, `setup_environment` was split into `setup_build_environment`
and `setup_run_environment`, with the `spack_env` and `run_env`
arguments being changed to `env`.  Somehow the flux package was the only
one to not have its `spack_env` references in the function changed to
`env`.

* flux: add runtime environment variables that Flux checks

with older versions of Flux (i.e, 0.0:0.13), FLUX_CONNECTOR_PATH must be
set by spack to prevent failures in certain
scenarios (https://github.com/flux-framework/flux-core/issues/2456).

the flux binary also sets some other environment variables, which can be
listed by running `flux -v start`.  I added a few of those just to be
sure that the Spack-installed paths are used, rather than
system-installed ones.

* flux: add optional testing dependencies to maximize test coverage

Install optional dependencies to ensure that only spack-installed
software is detected and that all tests are run when `spack install
--test` is used.

Flux's test suite will test for the existance of valgrind, jq, and any
MPI installation.  If it detects them (even if they are system-installed
and outside the spack environment), it will run optional tests against
them.  I noticed on my machine that the valgrind tests were running
against the system-install valgrind.

* flux-sched: switch to new `setup_run_environment` API
2019-11-04 09:58:40 -06:00
Adam J. Stewart
903b0071cf Add latest version of py-pybind11 (#13552)
* Add latest version of py-pybind11

* setup_environment -> setup_build_environment
2019-11-04 02:00:02 -08:00
Omar Padron
0784ec1a6d bugfix: fetch prefers to fetch local mirrors over remote resources (#13545)
- [x] insert at beginning of list so fetch grabs local mirrors before remote resources
- [x] update the S3FetchStrategy so that it throws a SpackError if the fetch fails.  
      Before, it was throwing URLError, which was not being caught in stage.py.
- [x] move error handling out of S3FetchStrategy and into web_util.read_from_url()
- [x] pass string instead of URLError to SpackWebError
2019-11-03 17:11:30 -08:00
Simon Pintarelli
bcda14f825 Add py-voluptuous (#13457)
Data validation library
2019-11-03 18:48:52 -06:00
Justin S
1d8391a60c r-gstat: new package at 2.0-3 (#13131)
* r-gstat: new package at 2.0-3

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

Co-Authored-By: Adam J. Stewart <ajstewart426@gmail.com>

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

Co-Authored-By: Adam J. Stewart <ajstewart426@gmail.com>
2019-11-03 18:35:08 -06:00
Greg Becker
aa7c229c8f environments: only write when necessary (#13546)
This changes Spack environments so that the YAML file associated with the environment is *only* written when necessary (i.e., if it is changed *by spack*).  The lockfile is still written out as before.

There is a larger question here of which part of Spack should be responsible for setting defaults in config files, and how we can get rid of empty lists and data structures currently cluttering files like `compilers.yaml`.  But that probably requires a rework of the default-setting validator in `spack.config`, as well as the code that uses `spack.config`.  This will at least help for `spack.yaml`.
2019-11-03 15:46:41 -08:00
Ricardo Silva
c42ebb0ccc Polymake: new version and more dependencies (#13399)
* New package: perl-term-readline-gnu

* polymake dependency

* perl-term-readline-gnu: flake8

* New package: perl-xml-libxslt

* polymake dependency

* ppl: new version 1.2

Conflicts:
	var/spack/repos/builtin/packages/ppl/package.py

* polymake: new version and dependencies

Conflicts:
	var/spack/repos/builtin/packages/polymake/package.py

* perl-xml-libxslt: missing dependency
2019-11-03 17:44:34 -06:00
Jannek Squar
9331a943ce New package py-wradlib with new dependencies (#13459)
* New package py-wradlib with new dependencies py-deprecation, py-semver, py-xmltodict

* Adjusted package source source

* Adjusted xarray package to use pypi-source

* Added dependencies

* Added explicit gdal+python dependency

* Concretised dependency versions

* Removed strict version range
2019-11-03 17:38:27 -06:00
Jannek Squar
c175be4420 Added dependencies (#13519)
* Added dependencies

* Adjusted dependency
2019-11-03 17:28:19 -06:00
Jannek Squar
ed037d0c5d Update package saga gis (#13520)
* Improvements of saga-gis package

* Added explicit version ranges for old saga-gis version

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

Creative usage of redefinition of getter method

Co-Authored-By: Adam J. Stewart <ajstewart426@gmail.com>

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

Co-Authored-By: Adam J. Stewart <ajstewart426@gmail.com>

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

Co-Authored-By: Adam J. Stewart <ajstewart426@gmail.com>
2019-11-03 17:26:53 -06:00