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Scientific Software
MDANSE
Commits
2ba36351
Commit
2ba36351
authored
Jan 27, 2016
by
eric pellegrini
Browse files
The default weight is now set to b_incoherent2
parent
a2129af9
Changes
1
Show whitespace changes
Inline
Side-by-side
MDANSE/Framework/Jobs/GaussianDynamicIncoherentStructureFactor.py
View file @
2ba36351
...
...
@@ -62,7 +62,7 @@ class GaussianDynamicIncoherentStructureFactor(IJob):
settings
[
'atom_selection'
]
=
(
'atom_selection'
,
{
'dependencies'
:{
'trajectory'
:
'trajectory'
}})
settings
[
'grouping_level'
]
=
(
'grouping_level'
,{
'dependencies'
:{
'trajectory'
:
'trajectory'
,
'atom_selection'
:
'atom_selection'
,
'atom_transmutation'
:
'atom_transmutation'
}})
settings
[
'atom_transmutation'
]
=
(
'atom_transmutation'
,
{
'dependencies'
:{
'trajectory'
:
'trajectory'
,
'atom_selection'
:
'atom_selection'
}})
settings
[
'weights'
]
=
(
'weights'
,
{
'default'
:
'b_incoherent'
,
'dependencies'
:{
'atom_selection'
:
'atom_selection'
}})
settings
[
'weights'
]
=
(
'weights'
,
{
'default'
:
'b_incoherent
2
'
,
'dependencies'
:{
'atom_selection'
:
'atom_selection'
}})
settings
[
'output_files'
]
=
(
'output_files'
,
{
'formats'
:[
"netcdf"
,
"ascii"
]})
settings
[
'running_mode'
]
=
(
'running_mode'
,{})
...
...
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