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mantidproject
mantid
Commits
68a28d2b
Commit
68a28d2b
authored
9 years ago
by
Anton Piccardo-Selg
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Merge pull request #13415 from mantidproject/13339_moldyn_diagram
Add diagram for MolDyn
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Code/Mantid/docs/source/algorithms/MolDyn-v1.rst
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Code/Mantid/docs/source/algorithms/MolDyn-v1.rst
Code/Mantid/docs/source/diagrams/MolDyn-v1_wkflw.dot
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Code/Mantid/docs/source/diagrams/MolDyn-v1_wkflw.dot
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Code/Mantid/docs/source/algorithms/MolDyn-v1.rst
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68a28d2b
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@@ -24,6 +24,11 @@ with actual instrument data.
When loading from a ``.dat`` file from nMOLDYN 3 function selection and
convolution with an instrument resolution are unavailable.
Workflow
========
.. diagram:: MolDyn-v1_wkflw.dot
Usage
-----
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Code/Mantid/docs/source/diagrams/MolDyn-v1_wkflw.dot
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digraph
MolDyn
{
label
=
"MolDyn Flowchart"
$
global_style
subgraph
descision
{
$
decision_style
Version
[
label
=
"nMoldyn version"
]
IfSave
[
label
=
"Save?"
]
IsWorkspaceInEnergy
[
label
=
"Is workspace in energy?"
]
IfSymmetrise
[
label
=
"SymmetriseEnergy?"
]
IfCrop
[
label
=
"Have MaxEnergy?"
]
IfConvolve
[
label
=
"Have Resolution workspace?"
]
}
subgraph
processes
{
$
process_style
ProcessEnergyWorkspaces
[
label
=
"Process energy workspaces"
]
}
subgraph
params
{
$
param_style
Data
Functions
Resolution
MaxEnergy
OutputWorkspace
}
subgraph
algorithms
{
$
algorithm_style
LoadNMoldyn3Ascii
LoadNMoldyn4Ascii
SaveNexus
Symmetrise
CropWorkspace
ConvolveWorkspaces
}
ProcessEnergyWorkspaces_Start
[
label
=
"Process energy workspaces"
]
ProcessEnergyWorkspaces_End
[
label
=
"End"
]
Data
->
Version
Functions
->
LoadNMoldyn3Ascii
Version
->
LoadNMoldyn3Ascii
[
label
=
"3"
]
Functions
->
LoadNMoldyn4Ascii
Version
->
LoadNMoldyn4Ascii
[
label
=
"4"
]
LoadNMoldyn3Ascii
->
ProcessEnergyWorkspaces
LoadNMoldyn4Ascii
->
ProcessEnergyWorkspaces
ProcessEnergyWorkspaces
->
OutputWorkspace
ProcessEnergyWorkspaces
->
IfSave
IfSave
->
SaveNexus
[
label
=
"Yes"
]
ProcessEnergyWorkspaces_Start
->
IsWorkspaceInEnergy
IsWorkspaceInEnergy
->
IfSymmetrise
[
label
=
"Yes"
]
MaxEnergy
->
Symmetrise
IfSymmetrise
->
Symmetrise
[
label
=
"Yes"
]
Symmetrise
->
IfConvolve
IfSymmetrise
->
IfCrop
[
label
=
"No"
]
MaxEnergy
->
CropWorkspace
IfCrop
->
CropWorkspace
[
label
=
"Yes"
]
CropWorkspace
->
IfConvolve
IfCrop
->
IfConvolve
[
label
=
"No"
]
IfConvolve
->
ConvolveWorkspaces
[
label
=
"Yes"
]
Resolution
->
ConvolveWorkspaces
ConvolveWorkspaces
->
ProcessEnergyWorkspaces_End
IfConvolve
->
ProcessEnergyWorkspaces_End
[
label
=
"No"
]
IsWorkspaceInEnergy
->
ProcessEnergyWorkspaces_End
[
label
=
"No"
]
}
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