Markus Kowalewski
2eee4e4eac
openmolcas: 19.11 -> 20.10
2020-10-19 14:13:08 +02:00
Markus Kowalewski
8b02ff6b8e
openmolcas: fix build w.r.t. openblas
...
Fall out from switching openblas over to multiple outputs:
https://github.com/NixOS/nixpkgs/pull/98337
2020-10-19 14:00:48 +02:00
R. RyanTM
0765b507f9
jmol: 14.31.2 -> 14.31.3
2020-09-23 23:36:41 -07:00
R. RyanTM
ee4c871ecd
marvin: 20.16.0 -> 20.17.0
2020-08-26 12:52:34 +00:00
Rohit Goswami
620f9049ae
d-seams: init at 1.0.1
2020-08-15 19:36:04 +00:00
Ryan Mulligan
ea39525ae7
Merge pull request #94779 from r-ryantm/auto-update/marvin
...
marvin: 20.15.0 -> 20.16.0
2020-08-09 12:45:42 -07:00
Markus Kowalewski
6c2f1e7f6b
octopus: 9.2 -> 10.0
2020-08-07 12:53:54 +02:00
R. RyanTM
4e6f70eaf8
marvin: 20.15.0 -> 20.16.0
2020-08-06 10:10:49 +00:00
Timo Kaufmann
9aab32b51c
Merge pull request #92796 from r-ryantm/auto-update/jmol
...
jmol: 14.31.0 -> 14.31.2
2020-07-09 18:43:50 +02:00
R. RyanTM
46e8ec7927
jmol: 14.31.0 -> 14.31.2
2020-07-09 14:44:34 +00:00
R. RyanTM
02fe1ec6ec
gwyddion: 2.55 -> 2.56
2020-07-07 10:11:50 -07:00
R. RyanTM
c0ebe721a9
marvin: 20.13.0 -> 20.15.0
2020-07-05 15:06:16 +00:00
Ryan Mulligan
d456800b17
Merge pull request #90045 from r-ryantm/auto-update/marvin
...
marvin: 20.12.0 -> 20.13.0
2020-06-10 06:01:10 -07:00
R. RyanTM
0f890be404
marvin: 20.12.0 -> 20.13.0
2020-06-10 12:01:26 +00:00
R. RyanTM
c04e2c41ca
jmol: 14.30.2 -> 14.31.0
2020-06-10 03:50:47 +00:00
Markus Kowalewski
5dbe275aac
molden: 6.2 -> 6.3
2020-06-06 23:41:01 +02:00
R. RyanTM
f4e01832ed
marvin: 20.10.0 -> 20.12.0
2020-05-27 12:11:37 -07:00
R. RyanTM
bdcefc1053
marvin: 20.9.0 -> 20.10.0
2020-05-06 23:16:23 -07:00
Matthew Bauer
ff2f2644f8
blas,lapack: use isILP64 instead of is64bit
...
This is a better name since we have multiple 64-bit things that could
be referred to.
LP64 : integer=32, long=64, pointer=64
ILP64 : integer=64, long=64, pointer=64
2020-04-20 16:02:43 -05:00
Matthew Bauer
1c8aba8334
treewide: use blas and lapack
...
This makes packages use lapack and blas, which can wrap different
BLAS/LAPACK implementations.
treewide: cleanup from blas/lapack changes
A few issues in the original treewide:
- can’t assume blas64 is a bool
- unused commented code
2020-04-17 16:24:09 -05:00
Michael Reilly
84cf00f980
treewide: Per RFC45, remove all unquoted URLs
2020-04-10 17:54:53 +01:00
Constantine Glen Evans
cacbbe92bf
gwyddion: add darwin support
...
Gwyddion will build on Darwin, but gnome2.gtkglext is broken there,
and so I am disabling it as an optional dependency here when building
on Darwin.
2020-04-01 17:50:36 -07:00
R. RyanTM
1d349b8512
marvin: 20.6.0 -> 20.9.0
2020-03-30 04:02:45 +00:00
Constantine Glen Evans
59fbc7acba
gwyddion: 2.48 -> 2.55 (and add options)
...
Gwyddion has a large number of optional dependencies. In this update,
those dependencies have been added with options set mostly to true,
and an option (default false) for working Python 2.7 support in the
program and in Python has been added. I have also added myself as a
maintainer as no maintainer is currently set.
2020-03-27 10:56:00 -07:00
markuskowa
dbb9fab27f
Merge pull request #81604 from markuskowa/upd-octopus
...
octopus: 9.1 -> 9.2
2020-03-03 12:45:16 +01:00
markuskowa
4822d61252
Merge pull request #80977 from r-ryantm/auto-update/quantum-espresso
...
quantum-espresso: 6.4.1 -> 6.5
2020-03-03 11:09:30 +01:00
Markus Kowalewski
eebd6fe75a
octopus: 9.1 -> 9.2
2020-03-03 10:54:23 +01:00
Brenton Horne
b07eb54048
marvin: 20.4.0 -> 20.6.0
2020-03-02 21:50:25 +01:00
R. RyanTM
56d58ecb24
quantum-espresso: 6.4.1 -> 6.5
2020-02-24 19:40:14 +00:00
Brenton Horne
567be48707
marvin: 20.3.0 -> 20.4.0
2020-02-10 19:55:13 +01:00
R. RyanTM
20f22f681f
marvin: 19.27.0 -> 20.3.0
2020-02-08 19:34:35 +00:00
R. RyanTM
097737b5a4
jmol: 14.30.1 -> 14.30.2
2020-02-01 03:50:56 +00:00
samlich
3376628557
pymol: cleanup
2020-01-25 19:58:36 +00:00
samlich
77317774ce
pymol: link desktop icon
2020-01-24 19:51:08 +00:00
samlich
3638755ff3
pymol: add samlich as maintainer
2020-01-24 19:49:38 +00:00
samlich
97410b59f3
pymol: 2.1.0 -> 2.3.0
2020-01-24 19:42:59 +00:00
Markus Kowalewski
a74b248f06
openmolcas: 18.09 -> 19.11
2020-01-07 15:36:59 +01:00
markuskowa
b06114f078
Merge pull request #76311 from r-ryantm/auto-update/marvin
...
marvin: 19.23.0 -> 19.27.0
2020-01-04 12:24:48 +01:00
Markus Kowalewski
63d62699e0
marvin: 19.25.0 -> 19.27.0
2019-12-25 15:11:16 +01:00
R. RyanTM
cf6d80a89d
marvin: 19.23.0 -> 19.25.0
2019-12-23 13:15:32 -08:00
R. RyanTM
398f11945e
jmol: 14.30.0 -> 14.30.1
2019-12-23 09:16:44 -08:00
markuskowa
444256039c
Merge pull request #75245 from r-ryantm/auto-update/jmol
...
jmol: 14.29.55 -> 14.30.0
2019-12-08 14:19:56 +01:00
R. RyanTM
b40940e9d6
jmol: 14.29.55 -> 14.30.0
2019-12-08 04:52:52 -08:00
R. RyanTM
8582e5a759
marvin: 19.1.0 -> 19.23.0
2019-12-07 20:41:41 +01:00
Frederik Rietdijk
5f8b0d7d99
Merge staging-next into staging
2019-11-19 14:53:29 +01:00
adisbladis
c9d8624ccd
treewide: Get rid of libGLU_combined
2019-11-18 20:10:43 +00:00
c0bw3b
9367367dfd
Treewide: fix URL permanent redirects
...
Permanent redirects on homepages and/or source URLs
as reported by Repology
2019-11-16 01:41:23 +01:00
R. RyanTM
b3799c5627
jmol: 14.29.54 -> 14.29.55
2019-11-02 00:16:58 -07:00
R. RyanTM
dbab6b7994
jmol: 14.29.53 -> 14.29.54
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/jmol/versions
2019-10-22 10:06:52 +02:00
Linus Heckemann
5aa4b19946
treewide: mark some broken packages as broken
...
Refs:
e6754980264fe927320d5ff2dbd24ca4fac9a160
1e9cc5b9844ef603fe160e9f671178f96200774f
793a2fe1e8bb886ca2096c5904e1193dc3268b6d
c19cf65261639f749012454932a532aa7c681e4b
f6544d618f30fae0bc4798c4387a8c7c9c047a7c
2019-10-08 17:14:26 +02:00
R. RyanTM
0826d695de
jmol: 14.29.49 -> 14.29.53
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/jmol/versions
2019-09-26 16:35:12 -07:00
volth
7b8fb5c06c
treewide: remove redundant quotes
2019-09-08 23:38:31 +00:00
volth
08f68313a4
treewide: remove redundant rec
2019-08-28 11:07:32 +00:00
Vladimír Čunát
2e6bf42a22
Merge branch 'master' into staging-next
...
There ver very many conflicts, basically all due to
name -> pname+version. Fortunately, almost everything was auto-resolved
by kdiff3, and for now I just fixed up a couple evaluation problems,
as verified by the tarball job. There might be some fallback to these
conflicts, but I believe it should be minimal.
Hydra nixpkgs: ?compare=1538299
2019-08-24 08:55:37 +02:00
Markus Kowalewski
a81bb36249
octopus: 9.0 -> 9.1
...
* switch to GitLab download
* cleanup fftw dependence
2019-08-19 10:24:44 +02:00
volth
c814d72b51
treewide: name -> pname
2019-08-17 10:54:38 +00:00
Frederik Rietdijk
fe9a3e3e63
Merge staging-next into staging
2019-08-17 09:39:23 +02:00
volth
46420bbaa3
treewide: name -> pname (easy cases) ( #66585 )
...
treewide replacement of
stdenv.mkDerivation rec {
name = "*-${version}";
version = "*";
to pname
2019-08-15 13:41:18 +01:00
Markus Kowalewski
5b0bbcbb6e
molden: 6.1 -> 6.2
2019-08-15 09:35:34 +02:00
R. RyanTM
5bb58479d7
jmol: 14.29.46 -> 14.29.49 ( #65951 )
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/jmol/versions
2019-08-04 22:09:13 +02:00
R. RyanTM
3775ef0acd
jmol: 14.29.42 -> 14.29.46 ( #63277 )
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/jmol/versions
2019-06-17 20:56:11 +02:00
volth
f3282c8d1e
treewide: remove unused variables ( #63177 )
...
* treewide: remove unused variables
* making ofborg happy
2019-06-16 19:59:05 +00:00
Markus Kowalewski
4df1e91b31
octopus: 8.4 -> 9.0
2019-06-11 13:02:54 +02:00
R. RyanTM
df3cdc29be
quantum-espresso: 6.4 -> 6.4.1 ( #62556 )
2019-06-04 19:24:04 +00:00
R. RyanTM
e20c69619f
jmol: 14.29.40 -> 14.29.42
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/jmol/versions
2019-06-01 17:19:25 -07:00
Markus Kowalewski
dce18eefd1
molden: 5.9.5 -> 6.1
2019-05-17 13:07:53 +02:00
R. RyanTM
06aa3d6f60
jmol: 14.29.36 -> 14.29.40
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/jmol/versions
2019-05-01 11:10:18 +02:00
R. RyanTM
c906798997
jmol: 14.29.32 -> 14.29.36 ( #59546 )
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/jmol/versions
2019-04-15 12:02:41 +02:00
markuskowa
e2ce5fd7fe
Merge pull request #58860 from r-ryantm/auto-update/quantum-espresso
...
quantum-espresso: 6.3 -> 6.4
2019-04-03 15:42:40 +02:00
Markus Kowalewski
c109aaa5cb
quantum-espresso: remove outdated makefile fix
2019-04-03 15:00:17 +02:00
R. RyanTM
882247fc3f
quantum-espresso: 6.3 -> 6.4
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/quantum-espresso/versions
2019-04-02 15:30:36 -07:00
R. RyanTM
5f4e5553bc
jmol: 14.29.31 -> 14.29.32 ( #58698 )
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/jmol/versions
2019-04-01 20:12:53 +00:00
Silvan Mosberger
aadb1cbe26
Merge pull request #58494 from markuskowa/upd-octopus
...
octopus: 8.3 -> 8.4
2019-03-29 20:43:28 +01:00
Markus Kowalewski
3c19324e2a
octopus: 8.3 -> 8.4
2019-03-28 18:00:41 +01:00
Markus Kowalewski
6ea9c0243b
molden: 5.9.3 -> 5.9.5
2019-03-28 17:39:15 +01:00
Timo Kaufmann
dbc771f2e1
Merge pull request #55299 from r-ryantm/auto-update/jmol
...
jmol: 14.29.29 -> 14.29.31
2019-02-06 13:15:46 +01:00
Markus Kowalewski
64e9f2ad65
jmol: remove redundant name attribute
...
version and pname are alrady present
2019-02-06 12:25:25 +01:00
R. RyanTM
a1360faba7
jmol: 14.29.29 -> 14.29.31
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/jmol/versions
2019-02-05 20:33:46 -08:00
markuskowa
9703765556
molden: 5.8.2 -> 5.9.3 ( #55044 )
2019-02-05 23:57:29 +02:00
Brenton Horne
6be5e679b1
marvin: init at 19.1.0
...
Also adding myself (fusion809) as a maintainer.
The marvin Nix file in this commit is largely thanks to @msteen.
2019-01-15 00:23:38 +10:00
Piotr Bogdan
ae7557c4cb
avogadro: fix libX11 underlinking
2019-01-04 21:13:57 +00:00
R. RyanTM
b26ba90c34
jmol: 14.29.28 -> 14.29.29 ( #52275 )
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/jmol/versions
2018-12-16 09:22:07 +01:00
R. RyanTM
b8e09ad0b5
octopus: 8.2 -> 8.3
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/octopus/versions
2018-12-14 19:45:56 -08:00
c0bw3b
0ea604ac1d
Treewide: use https for SourceForge
2018-11-24 19:58:03 +01:00
R. RyanTM
3902a47bed
jmol: 14.29.26 -> 14.29.28
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/jmol/versions
2018-11-09 16:17:35 -08:00
R. RyanTM
fedc17a99d
jmol: 14.29.22 -> 14.29.26
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/jmol/versions
2018-10-15 21:05:03 -07:00
Timo Kaufmann
87ca34b895
Merge pull request #47043 from r-ryantm/auto-update/jmol
...
jmol: 14.29.19 -> 14.29.22
2018-09-27 12:09:01 +02:00
markuskowa
6f6222c40f
openmolcas: 20180529 -> 18.09 ( #47410 )
2018-09-27 10:47:02 +02:00
R. RyanTM
730eb9f5f2
jmol: 14.29.19 -> 14.29.22
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/jmol/versions
2018-09-20 12:30:18 -07:00
Chris Ostrouchov
a2bc529f22
siesta: init at 4.0.2
2018-09-14 15:40:25 -04:00
Chris Ostrouchov
2c7295ebe0
quantum-espresso: init at 6.3
2018-09-14 15:40:14 -04:00
R. RyanTM
baf51804f0
jmol: 14.29.17 -> 14.29.19
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
jmol
2018-09-06 19:54:40 -07:00
Jörg Thalheim
4609e3abf2
Merge pull request #45303 from markuskowa/molden-up
...
molden: 5.7 -> 5.8.2
2018-08-19 13:32:28 +01:00
Markus Kowalewski
04d283ecda
molden: patch to deactivate extension installer script
2018-08-19 11:29:31 +02:00
Orivej Desh
65663f883c
msgpack: rename from libmsgpack
...
The project does not use the name "libmsgpack". It variously uses "msgpack" and
"msgpack-c", and "msgpackc" for the name of the library.
2018-08-18 23:19:54 +00:00
Markus Kowalewski
79bf57ca23
molden: 5.7 -> 5.8.2
2018-08-18 14:24:39 +02:00
Vladimír Čunát
209730208a
Merge branch 'staging-next'
2018-08-17 20:51:31 +02:00
R. RyanTM
ae846c0c03
octopus: 8.1 -> 8.2
...
Semi-automatic update generated by
https://github.com/ryantm/nixpkgs-update tools. This update was made
based on information from
https://repology.org/metapackage/octopus/versions .
2018-08-16 20:04:53 -07:00
Frederik Rietdijk
d9fa74ba78
Merge master into staging
2018-08-09 18:28:15 +02:00
symphorien
0ca40a51c7
gwyddion, ripser: fix derivation name ( #44577 )
2018-08-07 01:21:53 +02:00
John Ericson
85a9913edd
treewide: Make more complicated configureFlags lists
2018-08-03 17:06:03 -04:00
Markus Kowalewski
484473b184
openmolcas: init at 20180529
2018-08-02 10:18:17 +02:00
markuskowa
7f1bcb1ebf
octopus: 7.2 -> 8.1 (libxc 3.0.1 -> 4.2.3) ( #43484 )
2018-07-14 00:37:30 +02:00
Timo Kaufmann
d37c23c699
jmol: 14.29.12 -> 14.29.17 ( #43429 )
2018-07-12 22:31:52 +02:00
Ryan Mulligan
af9d10a91b
treewide: fix derivation names
2018-05-28 05:59:57 -07:00
Katona László
329d1ba69a
jmol: made it runnable
2018-04-25 22:42:07 +02:00
Katona László
75d8c81868
pymol: 1.8.4 -> 2.1.0
2018-04-25 22:15:51 +02:00
Joachim F
36d58a2cd2
Merge pull request #39332 from markuskowa/octopus-up
...
octopus: 7.2 -> 7.3
2018-04-22 17:47:26 +00:00
Markus Kowalewski
1d0267b2e7
octopus: 7.2 -> 7.3
2018-04-22 08:43:19 -07:00
Timo Kaufmann
b93e1fbbfb
jmol: init at 14.29.12
2018-04-21 20:41:21 -05:00
Alexander V. Nikolaev
0acec7e984
treewide: transition mesa to libGLU_combined
2018-02-24 17:06:49 +02:00
Alexander V. Nikolaev
1bc1909e5b
treewide: transition from mesa_glu to libGLU
2018-02-24 17:05:43 +02:00
Jörg Thalheim
a0a3f674a7
Merge pull request #34094 from markuskowa/octopus-pr
...
octopus: init at 7.2
2018-02-10 14:14:01 +00:00
Markus Kowalewski
ec6e7c6eeb
octopus: init at 7.2
2018-01-27 16:23:04 -08:00
Markus Kowalewski
1c1e49a5c5
molden: init at 5.7
2018-01-15 23:06:41 -08:00
John Ericson
531e4b80c9
misc pkgs: Basic sed to get fix pkgconfig
and autoreconfHook
buildInputs
...
Only acts on one-line dependency lists.
2017-09-21 15:49:53 -04:00
pe@pijul.org
443ac23336
Gwyddion: init at 2.48
2017-08-11 20:30:11 +02:00
Silvan Mosberger
f5fa5fa4d6
pkgs: refactor needless quoting of homepage meta attribute ( #27809 )
...
* pkgs: refactor needless quoting of homepage meta attribute
A lot of packages are needlessly quoting the homepage meta attribute
(about 1400, 22%), this commit refactors all of those instances.
* pkgs: Fixing some links that were wrongfully unquoted in the previous
commit
* Fixed some instances
2017-08-01 22:03:30 +02:00
Jörg Thalheim
c972f01e2d
pymol: set PYTHONPATH in a future way
2017-06-02 21:55:16 +01:00
Katona László
2a1c535b7e
pymol: added Pmw + python version bump
2017-06-02 19:58:00 +02:00
Vladimír Čunát
96d41e393d
treewide: purge maintainers.urkud
...
It's sad, but he's been inactive for the last five years.
Keeping such people in meta.maintainers is counter-productive.
2017-03-27 19:52:29 +02:00
Franz Pletz
67018e7759
pymol: fix evaluation
...
cc #23007 @Mounium @Mic92
2017-02-22 08:48:42 +01:00
Mounium
eb688ac0a7
pymol: init at 1.8.4 ( #23007 )
2017-02-22 01:35:09 +01:00
Evgeny Egorochkin
69bb44994e
avogadro: build documentation
2013-12-18 18:18:22 +02:00
Nixpkgs Monitor
de403540ab
avogadro: update from 1.0.3 to 1.1.1
2013-12-18 18:18:18 +02:00
Eelco Dolstra
2147a07938
Fix a bunch of Hydra evaluation errors
2013-10-07 17:36:47 +02:00
Bjørn Forsman
28ac782583
Some description fixes
...
There are many more packages to fix, this is just a start.
Rules:
* Don't repeat the package name (not always that easy...)
* Start with capital letter
* Don't end with full stop
* Don't start with "The ..." or "A ..."
I've also added descriptions to some packages and rewritten others.
2013-10-05 19:36:23 +02:00
Eelco Dolstra
ab3eeabfed
Rename buildNativeInputs -> nativeBuildInputs
...
Likewise for propagatedBuildNativeInputs, etc. "buildNativeInputs"
sounds like an imperative rather than a noun phrase.
2012-12-28 19:20:09 +01:00
Yury G. Kudryashov
cced3d2b86
Fix compilation with qt-4.8
...
- Explicitly depend on libX11 and mesa
- Include GL/glu.h
svn path=/nixpkgs/trunk/; revision=31552
2012-01-14 18:03:41 +00:00
Yury G. Kudryashov
c2e38f32c0
avogadro: explicitly depend on pkg-config
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svn path=/nixpkgs/trunk/; revision=31541
2012-01-14 18:03:01 +00:00
Yury G. Kudryashov
a660093a4d
Fix typo in URL
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svn path=/nixpkgs/trunk/; revision=28603
2011-08-15 23:39:11 +00:00
Yury G. Kudryashov
0962beade0
Add avogadro
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svn path=/nixpkgs/trunk/; revision=28596
2011-08-15 18:05:39 +00:00