2023-12-16 19:24:22 +00:00
|
|
|
-------------------------------------------------------------------
|
|
|
|
|
Sat Dec 16 19:23:44 UTC 2023 - Dirk Müller <dmueller@suse.com>
|
|
|
|
|
|
|
|
|
|
- update to 1.0.2:
|
|
|
|
|
* Python 3.12 is now supported (PR #128)
|
|
|
|
|
* Use new MDAnalysis docs theme (PR #127)
|
|
|
|
|
* updated versioneer to be able to run under Python 3.12
|
|
|
|
|
* replaced deprecated pkg_resources in tests with importlib
|
|
|
|
|
|
2023-05-02 10:47:42 +00:00
|
|
|
-------------------------------------------------------------------
|
|
|
|
|
Tue May 2 09:00:52 UTC 2023 - pgajdos@suse.com
|
|
|
|
|
|
|
|
|
|
- version update to 1.0.1
|
|
|
|
|
1.0.1
|
|
|
|
|
-----
|
|
|
|
|
Changes
|
|
|
|
|
* Deployment is now automatically done using github actions.
|
|
|
|
|
Fixes
|
|
|
|
|
* Version 1.0.0 would allow for installations to be made with python versions
|
|
|
|
|
< 3.8, resulting in incorrect builds. The setup configuration has now been
|
|
|
|
|
altered to avoid this (Issue #112)
|
|
|
|
|
|
|
|
|
|
1.0.0
|
|
|
|
|
-----
|
|
|
|
|
Changes
|
|
|
|
|
* API-stable release
|
|
|
|
|
* deprecated and buggy CCP4 module was removed (#107, #50)
|
|
|
|
|
* gridDataFormats now follows NEP29 (#102)
|
|
|
|
|
* removed support for Python 2.7 and Python <3.8 (#102)
|
|
|
|
|
|
|
|
|
|
0.7.0
|
|
|
|
|
-----
|
|
|
|
|
Changes
|
|
|
|
|
* Python 3.10 is supported (issue #101)
|
|
|
|
|
Enhancements
|
|
|
|
|
* use mrcfile library to parse MRC files (including CCP4) using the
|
|
|
|
|
new mrc.MRC class (issue #83)
|
|
|
|
|
Fixes
|
|
|
|
|
* The new mrc module correctly reorients the coordinate system based
|
|
|
|
|
on mapc, mapr, maps and correctly calculates the origin (issue #76)
|
|
|
|
|
* documented Grid attributes, including axis convention (issue #69)
|
|
|
|
|
Deprecations
|
|
|
|
|
* The CCP4 module (replaced by mrc) will be removed in 1.0.0
|
|
|
|
|
|
|
|
|
|
0.6.0
|
|
|
|
|
-----
|
|
|
|
|
Changes
|
|
|
|
|
* macOS and Windows are also tested (min and max supported Python, #97)
|
|
|
|
|
Enhancements
|
|
|
|
|
* Allow parsing/writing gzipped DX files (PR #70, #99)
|
|
|
|
|
* Update doc theme to use sphinx-rtd-theme (#80)
|
|
|
|
|
* Delta of OpenDX writes 7 significant figures (#88)
|
|
|
|
|
Fixes
|
|
|
|
|
* fix initialization of mutable instance variable of Grid class (metadata dict) (#71)
|
|
|
|
|
* fix multiple __init__ calls (#73)
|
|
|
|
|
* interpolation behavior outside of the grid changed to default to a
|
|
|
|
|
constant rather than the nearest value (#84)
|
|
|
|
|
* corrected resampling behavior to not draw on values outside of the grid (#84)
|
|
|
|
|
|
|
|
|
|
|
2021-04-20 02:57:29 +00:00
|
|
|
-------------------------------------------------------------------
|
|
|
|
|
Tue Apr 20 02:54:06 UTC 2021 - Steve Kowalik <steven.kowalik@suse.com>
|
|
|
|
|
|
2023-12-16 19:24:22 +00:00
|
|
|
- Do not build for Python 3.6, due to no NumPy.
|
2021-04-20 02:57:29 +00:00
|
|
|
|
2019-07-23 20:36:48 +00:00
|
|
|
-------------------------------------------------------------------
|
|
|
|
|
Tue Jul 23 02:20:35 UTC 2019 - Todd R <toddrme2178@gmail.com>
|
|
|
|
|
|
|
|
|
|
- Update to 0.5.0
|
|
|
|
|
+ Changes
|
|
|
|
|
* supported/tested on Python 2.7, >=3.5 (official 3.4 support was
|
|
|
|
|
dropped: it might still work but is not tested anymore)
|
|
|
|
|
+ Enhancements
|
|
|
|
|
* Allow parsing DX files by NAMD's GridForces module (new typequote keyword)
|
|
|
|
|
* New keyword argument ``Grid(grid=<file>, file_format=<str>)`` to set file format when
|
|
|
|
|
reading from a file
|
|
|
|
|
+ Fixes
|
|
|
|
|
* Allow parsing DX files by Pymol's buggy floating-point parser
|
|
|
|
|
* Fixed loading of pickle files with .pkl suffix
|
|
|
|
|
* Better input handling when constructing a Grid object
|
|
|
|
|
- Remove upstream-included no_float128.patch
|
|
|
|
|
|
2018-05-29 08:29:14 +00:00
|
|
|
-------------------------------------------------------------------
|
|
|
|
|
Tue May 15 18:49:17 UTC 2018 - toddrme2178@gmail.com
|
|
|
|
|
|
|
|
|
|
- Add no_float128.patch
|
|
|
|
|
Fixes tests
|
|
|
|
|
See https://github.com/MDAnalysis/GridDataFormats/issues/44
|
|
|
|
|
From https://github.com/MDAnalysis/GridDataFormats/pull/45/commits/069422d54344034b8f31bb19eee8a097b582c0e1
|
|
|
|
|
Should be in next release
|
|
|
|
|
|
|
|
|
|
-------------------------------------------------------------------
|
|
|
|
|
Fri May 11 22:22:31 UTC 2018 - toddrme2178@gmail.com
|
|
|
|
|
|
|
|
|
|
- Update to 0.4.0
|
|
|
|
|
* Type of DX arrays is now set based on the numpy array dtype or can
|
|
|
|
|
be manually set by the user to increase interoperability with
|
|
|
|
|
tools such as PyMOL (issue #35)
|
|
|
|
|
|
|
|
|
|
-------------------------------------------------------------------
|
|
|
|
|
Mon May 15 21:09:08 UTC 2017 - toddrme2178@gmail.com
|
|
|
|
|
|
|
|
|
|
- Implement single-spec version.
|
|
|
|
|
- Fix source URL.
|
|
|
|
|
- Run unit tests.
|
|
|
|
|
|
|
|
|
|
-------------------------------------------------------------------
|
|
|
|
|
Thu Nov 17 10:13:47 UTC 2016 - alinm.elena@gmail.com
|
|
|
|
|
|
2023-12-16 19:24:22 +00:00
|
|
|
- updated to version 0.3.3
|
2018-05-29 08:29:14 +00:00
|
|
|
* removed SUMMARY.txt
|
|
|
|
|
-------------------------------------------------------------------
|
|
|
|
|
Wed Mar 12 13:46:25 UTC 2014 - toddrme2178@gmail.com
|
|
|
|
|
|
|
|
|
|
- Update to 2.4
|
|
|
|
|
* No upstream changelog
|
|
|
|
|
|
|
|
|
|
-------------------------------------------------------------------
|
|
|
|
|
Thu Oct 24 11:06:21 UTC 2013 - speilicke@suse.com
|
|
|
|
|
|
|
|
|
|
- Require python-setuptools instead of distribute (upstreams merged)
|
|
|
|
|
|
|
|
|
|
-------------------------------------------------------------------
|
|
|
|
|
Fri Jun 22 12:36:30 UTC 2012 - saschpe@suse.de
|
|
|
|
|
|
|
|
|
|
- Update to version 0.2.2:
|
|
|
|
|
+ Upstream provides no changelog
|
|
|
|
|
|
|
|
|
|
-------------------------------------------------------------------
|
|
|
|
|
Thu Jan 12 10:19:15 UTC 2012 - saschpe@suse.de
|
|
|
|
|
|
|
|
|
|
- Package AUTHORS, COPYING, README
|
|
|
|
|
- Spec cleanup:
|
|
|
|
|
+ Removed %clean section (sane default)
|
|
|
|
|
+ Simpler macros
|
|
|
|
|
+ No CFLAGS for Python-only package needed
|
|
|
|
|
|
|
|
|
|
-------------------------------------------------------------------
|
|
|
|
|
Wed Jan 11 14:56:08 UTC 2012 - toddrme2178@gmail.com
|
|
|
|
|
|
|
|
|
|
- Cleaned up spec file
|
|
|
|
|
|
|
|
|
|
-------------------------------------------------------------------
|
|
|
|
|
Thu Sep 8 23:50:57 UTC 2011 - alinm.elena@gmail.com
|
|
|
|
|
|
2023-12-16 19:24:22 +00:00
|
|
|
- initial commit
|
2018-05-29 08:29:14 +00:00
|
|
|
|
