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
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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
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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
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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
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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
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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:
e6754980261e9cc5b984793a2fe1e8c19cf65261f6544d618f
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
