A new compute function

[andrewtarzia]

The idea is to simplify the analysis of time series, so I envisage a function/class that takes a trajectory and an analysis function that outputs a float|array for each time step, then dynsight can automatically provided some statistics and plots?

Something like:

compute_and_plot(
    trajectory: mda.Universe,
    compute_function: Callable,
    output_path: pathlib.Patb, # where files are saved.
)

compute_function = function(Universe) -> float

I think these could also be Recipes, which have separate dependencies that allow testing and use things like:

• stk and pywindow to monitor structure features of a simulation