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hdf5 storage #2

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@organic-chemistry

Hi, I wanted to use caching option in a file,
but I think that the file that store the data is going to grow fast.
Do you think it could be interesting to store data in hdf5 files,
like that we could only retrieve the appropriate data at each call ?
(I am no expert in hdf5 format, but I think that it works like that)
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