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parser-namd
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nomad-lab
parser-namd
Commits
efd8e850
Commit
efd8e850
authored
Jan 22, 2018
by
Berk Onat
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Change dictionary to clean push order to backend.
parent
2b3c8829
Pipeline
#23916
failed with stage
in 14 minutes and 32 seconds
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1
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parser/parser-namd/NAMDDictionary.py
parser/parser-namd/NAMDDictionary.py
+10
-10
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parser/parser-namd/NAMDDictionary.py
View file @
efd8e850
...
...
@@ -632,16 +632,16 @@ def get_updateDictionary(self, defname):
'time_single_configuration_calculation_date_start'
:
MetaInfoMap
(
startpage
),
'time_single_configuration_calculation_wall_end'
:
MetaInfoMap
(
startpage
),
'time_single_configuration_calculation_wall_start'
:
MetaInfoMap
(
startpage
),
'stress_tensor_kind'
:
MetaInfoMap
(
startpage
,
depends
=
[
{
'test'
:
[[
'minimization'
,
' is not None'
]],
'assign'
:
'geometry_optimization'
},
{
'test'
:
[[
'minimization'
,
' is None'
]],
'assign'
:
'molecular_dynamics'
}
],
activeInfo
=
True
,
lookupdict
=
self
.
extraDict
),
#
'stress_tensor_kind' : MetaInfoMap(startpage,
#
depends=[
#
{'test' : [['minimization', ' is not None']],
#
'assign' : 'geometry_optimization'},
#
{'test' : [['minimization', ' is None']],
#
'assign' : 'molecular_dynamics'}
#
],
#
activeInfo=True,
#
lookupdict=self.extraDict
#
),
'stress_tensor_value'
:
MetaInfoMap
(
startpage
)
}
...
...
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