CHANGELOG 2.58 KB
Newer Older
1
2
3
4
version 1.0.6.a
----------------
* bug fix when setting the commit id in __pkginfo__

5
6
7
8
9
10
11
12
13
14
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

15
16
17
18
19
20
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
21
22
23
24
----------------
* 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
25
version 1.0.4.rc2
26
----------------
eric pellegrini's avatar
eric pellegrini committed
27
* added support for gitflow bugfix branch to gitlab config file
eric pellegrini's avatar
eric pellegrini committed
28
* the DL_POLY converter is now compliant with DL_POLY 4
29
30
31
* added the mass tolerance to LAMMP converter
* updated the LAMMP example trajectory with more accurate masses

32
33
34
35
36
37
38
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

39
40
41
42
43
version 1.0.3.e:
----------------
* bug fix relative to REGISTRY update

version 1.0.3.d:
eric pellegrini's avatar
eric pellegrini committed
44
----------------
eric pellegrini's avatar
eric pellegrini committed
45
46
47
48
49
50
51
52
53
* 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
54
55
56
57
58
59
60
* 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

61
version 1.0.3.c:
eric pellegrini's avatar
eric pellegrini committed
62
63
64
65
66
67
68
----------------
* 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
69