ISISNeutronMuon / MDANSE

MDANSE: Molecular Dynamics Analysis for Neutron Scattering Experiments
https://www.isis.stfc.ac.uk/Pages/MDANSEproject.aspx
GNU General Public License v3.0
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Mdmc mdanse integration #287

Closed MBartkowiakSTFC closed 9 months ago

MBartkowiakSTFC commented 9 months ago

Description of work The MDANSE analysis runs now accept also MDMC wrapper objects instead of an actual HDF5 trajectory.

Fixes Override mechanism added to change the settings of an MDANSE job. Also fixed the formatting using the new version of black.

To test Unit tests still pass. For actual testing of the new functionality MDMC is needed.