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GEMDAT-repos / GEMDAT

Python toolkit for molecular dynamics analysis
https://gemdat.readthedocs.io
Apache License 2.0
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rectilinear plot #286

Closed tfamprikis closed 3 months ago

tfamprikis commented 3 months ago

should take a cartesian directory array (e.g. created by Orientations.get_unit_vectors_trajectory()) argument alternatively to (instead of?) an Orientations object.

also, right now assumes that a primitive to conventional conversion needs to happen but this should be optional and not default.

stefsmeets commented 3 months ago

@SCiarella is this solved by #293?

SCiarella commented 3 months ago

I would say that this specific problem is solved. We will open a new issue if #293 is not general enough.