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Remove charged frag types filtering #266

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@GeorgWa GeorgWa commented Jan 6, 2025

Add validation and soarting on loading and fixing a bit of a design flaw :D

Currently SpecLibBase removes frag types not in self.charged_frag_types.
To load them the user would need to know before loading what fragments to expect in a library.
Instead, the loading process should set sorted and valid self.charged_frag_types from the hdf.

@GeorgWa GeorgWa requested review from jalew188 and mschwoer January 6, 2025 09:53
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