CHANGELOG 4.57 KB
Newer Older
Remi Perenon's avatar
Remi Perenon committed
1
2
version 1.2.0
--------------
Remi Perenon's avatar
Remi Perenon committed
3
* ADDED issue #10 Implemented Gromacs trajectory converter
eric pellegrini's avatar
eric pellegrini committed
4
* FIXED issue #20 Opening the theoretical help on MacOS is now OK
Remi Perenon's avatar
Remi Perenon committed
5
* FIXED issue #21 "Save a template for new analysis" button produced an error
Remi Perenon's avatar
Remi Perenon committed
6
* CHANGED (internal) MDANSE is now built with system python (2.7.10)
Remi Perenon's avatar
Remi Perenon committed
7

Remi Perenon's avatar
Remi Perenon committed
8
9
10
11
12
version 1.1.3
--------------
* FIXED issue #17 The plotter crashed when user was clicking on "plot in new window"
* FIXED issue #19 Users could not display user definitions

13
14
15
16
version 1.1.2
--------------
* ADDED issue #15 An automatic mode for data loading is added to compel with the fact that data filter does not appear in data loading popup on macOS

17
18
19
20
21
version 1.1.1
--------------
* FIXED issue #14 Package name was not valid for debian package in 1.1.0 version
* CHANGED Moving artifacts for more convenient user downloading

Remi Perenon's avatar
Remi Perenon committed
22
version 1.1.0
23
--------------
Remi Perenon's avatar
Remi Perenon committed
24
25
26
* ADDED issue #11 MDANSE is now compliant with 16.04 and 18.04 Ubuntu systems
* ADDED issue #12 MDANSE has now three different development phases (beta, rc, release)
* CHANGED Replacing all "output_file" occurences by "output_files" /!\ Modifies API /!\
Remi Perenon's avatar
Remi Perenon committed
27
* FIXED issue #13 The changelog was not updated in the windows installer
Remi Perenon's avatar
Remi Perenon committed
28
29
30
31
32
* FIXED issue #9 updated the macos build scripts in order to have an universal dmg
* FIXED issue #7 suppression of the appearance of an error dialog when closing widgets
* ADDED (internal) Reference data files integrated in functional tests
* CHANGED (internal) MDANSE is now build on new build servers (2018)
* CHANGED (internal) Complete refactoring of build scripts
33

34
35
36
37
version 1.0.11
-------------
* bug fix when converting MS trajectories due to a too small value for recursionlimit parameter

38
39
40
41
42
version 1.0.10
-------------
* bug fix due to missing import in ElementsDatabaseEditor
* bug fix when loading trajectory with missing unknown MMTK atoms

43
44
45
46
version 1.0.9
-------------
* use the short git commit id instead of long

47
48
49
50
version 1.0.8
-------------
* bug fix when getting git commit id in long format

51
52
53
54
version 1.0.7
-------------
* = 1.0.6.a

55
56
57
58
version 1.0.6.a
----------------
* bug fix when setting the commit id in __pkginfo__

59
60
61
62
63
64
65
66
67
68
version 1.0.6
----------------
* the bug report button opens now the default mail client for sending bug report
* the __pkginfo__ is now updated with the commit id when MDANSE is built

version 1.0.5
----------------
* bug fix on macos when closing the application from the Finder: the jobs manager thread was not properly closed
* the macos dmg file was corrupted due to the use of pkg_resources module for storing resources

69
70
71
72
73
74
version 1.0.4.rc4
----------------
* bug fix in coordination number analysis: some pairs were never taken into account
* bug fix when transmutating atoms from an atom selection different to 'all'

version 1.0.4.rc3
75
76
77
78
----------------
* bug fix in debian packager: add the python-setuptools dependency
* improved LAMMPS converter: the parsing of the config file is more tolerance in term of required keyword format

eric pellegrini's avatar
eric pellegrini committed
79
version 1.0.4.rc2
80
----------------
eric pellegrini's avatar
eric pellegrini committed
81
* added support for gitflow bugfix branch to gitlab config file
eric pellegrini's avatar
eric pellegrini committed
82
* the DL_POLY converter is now compliant with DL_POLY 4
83
84
85
* added the mass tolerance to LAMMP converter
* updated the LAMMP example trajectory with more accurate masses

86
87
88
89
90
91
92
version 1.0.4.rc1
----------------
* bug fix in IWidget: the label of the configurator was not taken into account
* bug fix path_to_module function: the list of directories has to be parsed backwards
* raise an error when none or more than atom matches the mass stored in the LAMMPS config file
* modified the label for r value

93
94
95
96
97
version 1.0.3.e:
----------------
* bug fix relative to REGISTRY update

version 1.0.3.d:
eric pellegrini's avatar
eric pellegrini committed
98
----------------
eric pellegrini's avatar
eric pellegrini committed
99
100
101
102
103
104
105
106
107
* redirected the sys.stdout and sys.stderr to the LOGGER
* implemented a write method so as ConsoleHandler behaves as a file-like object
* the job short name appears now explicitely in the saved job files
* small refactoring of MDANSE __init__
* small refactoring of ClassRegistry
* removed the explicit imports of the framework classes
* the plotter show the last loaded data now
* bug fix in rmsd job: the PBC were not applied to the calculation
* bug fix in AtomSelectionConfigurator::get_indexes
eric pellegrini's avatar
eric pellegrini committed
108
109
110
111
112
113
114
* bug fix when saving user definitions
* bug fix with the initial size of the user definitions plugins
* updated the job template writing
* small refactoring of the save job template command line option
* removed unused imports
* removed white spaces

115
version 1.0.3.c:
eric pellegrini's avatar
eric pellegrini committed
116
117
118
119
120
121
122
----------------
* bug fix with JobControllerPanel in case of crashing jobs
* regression fixed due to trials to get rid of relative imports MDANSE/Externals/pubsub package

version 1.0.3.a:
----------------
* updated `MDANSE/__pkginfo__.py` module
123