Commits · 2ba36351b251b9222dc336ac23ca4ae2e712c63b · Scientific Software / MDANSE

27 Jan, 2016 3 commits
- The default weight is now set to b_incoherent2 · 2ba36351
  eric pellegrini authored Jan 27, 2016
  
  2ba36351
- An output variable has 'index' as axis by default now · a2129af9
  eric pellegrini authored Jan 27, 2016
  
  a2129af9
- Remove the units column from the plotter data tree · 49595411
  eric pellegrini authored Jan 27, 2016
```
Added size column to the plotter data tree
Take into acoount the unit when exporting data now
```
  49595411
26 Jan, 2016 3 commits
- Bug fix when computing FFT using odd number of points · 86e5e80c
  eric pellegrini authored Jan 26, 2016
  
  86e5e80c
- Bug fix in DL_POLY converter when guessing element from sitnam · f6aa12ab
  eric pellegrini authored Jan 26, 2016
  
  f6aa12ab
- Bug fix due to PyDeadObjectError when destroying a widow without · 3ce2c6a1
  eric pellegrini authored Jan 26, 2016
```
unsubing the listener
```
  3ce2c6a1
19 Jan, 2016 1 commit
- Improved the behaviour of the atom selection plugin and its connection · 09b8b685
  eric pellegrini authored Jan 19, 2016
```
with the molecular viewer plugin
Redesigned the partial charges plugin
```
  09b8b685
13 Jan, 2016 1 commit
- Changed the default unit for mass density to g/cm3 · 8ef469c9
  eric pellegrini authored Jan 13, 2016
  
  8ef469c9
12 Jan, 2016 2 commits
- Bug fix in Density analysis when computing mass density · 51b9b2b1
  eric pellegrini authored Jan 12, 2016
  
  51b9b2b1
- Modifed the caption of the working panel · 598d9b62
  eric pellegrini authored Jan 12, 2016
  
  598d9b62
10 Dec, 2015 1 commit
- Added a close event to UserDefinitionViewer dialog · 6e4e551f
  eric pellegrini authored Dec 10, 2015
  
  6e4e551f
08 Dec, 2015 3 commits
- bug fix with cross plot legends · 328f91c3
  eric pellegrini authored Dec 08, 2015
  
  328f91c3
- bug fix when combining dcsf analysis · 55d72a4e
  eric pellegrini authored Dec 08, 2015
  
  55d72a4e
- bug fix when reading atoms trajectory in the case of a single atom · dac79755
  eric pellegrini authored Dec 08, 2015
  
  dac79755
04 Dec, 2015 1 commit
- regression fixed when defining q vectors · 4672d8df
  eric pellegrini authored Dec 04, 2015
  
  4672d8df
03 Dec, 2015 1 commit
- test · d92a449d
  eric pellegrini authored Dec 03, 2015
  
  d92a449d
24 Nov, 2015 6 commits
- Modify the behaviour of MMTK database in case of an unknown element: now · 9468b150
  eric pellegrini authored Nov 24, 2015
```
create the mmtk + MDANSE dbs corresponding entries
```
  9468b150
- Improved the error message in case of loading failure · 85a51bb3
  eric pellegrini authored Nov 24, 2015
  
  85a51bb3
- typo · b13352ca
  eric pellegrini authored Nov 24, 2015
  
  b13352ca
- The elements database is now accessed in lower case · 0abf4b41
  eric pellegrini authored Nov 24, 2015
  
  0abf4b41
- remove unused import · 925979f6
  eric pellegrini authored Nov 24, 2015
  
  925979f6
- Bug fix when viewing a newly created element (no color set in the db) · 2c51b38b
  eric pellegrini authored Nov 24, 2015
  
  2c51b38b
23 Nov, 2015 1 commit
- Bug fix when updating parameters panel · 80e330c9
  eric pellegrini authored Nov 23, 2015
  
  80e330c9
19 Nov, 2015 2 commits
- Updated the modules impacted by previous commit · 1cb9aeb0
  eric pellegrini authored Nov 19, 2015
  
  1cb9aeb0
- Relocated DataController module for solving cycling import problem · 0d1e88a2
  eric pellegrini authored Nov 19, 2015
  
  0d1e88a2
17 Nov, 2015 6 commits
- Modifed the code according to changes made in ConfigurationPanel API · f9f8ed9a
  eric pellegrini authored Nov 17, 2015
  
  f9f8ed9a
- Set the default weight of disf to b_incoherent2 · 7338bd81
  eric pellegrini authored Nov 17, 2015
  
  7338bd81
- Added raise condition when getting atom_transmutation widget value · 0db554c6
  eric pellegrini authored Nov 17, 2015
  
  0db554c6
- Removed unused line · 95ff53dc
  eric pellegrini authored Nov 17, 2015
  
  95ff53dc
- Bug fix with ideal resolution that was not displayed · 53fcb0fb
  eric pellegrini authored Nov 17, 2015
  
  53fcb0fb
- Added b_incoherent2 (=b_inc*b_inc) property in database · 55abae46
  eric pellegrini authored Nov 17, 2015
  
  55abae46
12 Nov, 2015 1 commit
- Bug fix when parsing expression with several or/and operators · 3e4f1c4f
  eric pellegrini authored Nov 12, 2015
  
  3e4f1c4f
11 Nov, 2015 8 commits
- Added the python script selector in the GUI · e3565a77
  eric pellegrini authored Nov 11, 2015
  
  e3565a77
- Removed print · b978d9ce
  eric pellegrini authored Nov 11, 2015
  
  b978d9ce
- Bug fix with QVectorsPlugin when trying to close the first q vectors tab · 00c4d6e3
  eric pellegrini authored Nov 11, 2015
```
Bug fix with SphericalQVectors (no status start defined)
```
  00c4d6e3
- The QVectors and partial charges plugins have mmtk_trajectory as parent · 3463d2d4
  eric pellegrini authored Nov 11, 2015
  
  3463d2d4
- Bug fix in VectorWidget · fecdb8d8
  eric pellegrini authored Nov 11, 2015
  
  fecdb8d8
- Bug fix when saving elements database · e774644c
  eric pellegrini authored Nov 11, 2015
  
  e774644c
- Bug fix when not accepting to close a plugin · e41633ae
  eric pellegrini authored Nov 11, 2015
```
Bug fix when changing selection keyword
Bug fix when setting a new atom selection from atom_transmutation widget
```
  e41633ae
- Bug fix when displaying X-H hydrogens · a2805403
  eric pellegrini authored Nov 11, 2015
```
Added a selector for selector hydrogen linked to sulphur atoms
```
  a2805403