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Update analysis job list
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MDANSE/README.md

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@@ -77,6 +77,8 @@ into an .MDT file (HDF format), which is then used for all calculations. The fol
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- CASTEP
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- CHARMM
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- CP2K
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- DCD
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- DFTB
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- Discover
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- DL_POLY
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- Gromacs
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- LAMMPS
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- NAMD
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- PDB
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- VASP
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- XPLOR
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- ASE
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</ul></details>
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<details><summary>Scattering</summary><ul>
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<li>Current correlation function</li>
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<li>Dynamic Coherent Structure Factor</li>
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<li>Dynamic Incoherent Structure Factor</li>
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<li>Elastic Incoherent Structure Factor</li>
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<li>Root Mean Square Fluctuation</li>
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<li>Radius of Gyration</li>
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<li>Solvent Accessible Surface</li>
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<li>Spatial Density</li>
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<li>Static Structure Factor</li>
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<li>Voronoi (volume per atom)</li>
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<li>X-Ray Static Structure Factor</li>

MDANSE/Src/MDANSE/Framework/Jobs/GeneralAutoCorrelationFunction.py

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@@ -26,6 +26,8 @@ class GeneralAutoCorrelationFunction(IJob):
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Computes the autocorrelation for any available trajectory variable.
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"""
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enabled = False
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label = "General AutoCorrelation Function"
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category = (

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