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  • Marco Biasini's avatar
    d7882129
    improve GuessAtomElement · d7882129
    Marco Biasini authored 
    It seems, just looking at the number of atoms is not enough,
we also have to look at the hetatm flag. The whole element
guessing code is still quite shaky and should be improved.
    d7882129
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    improve GuessAtomElement
    Marco Biasini authored 
    It seems, just looking at the number of atoms is not enough,
we also have to look at the hetatm flag. The whole element
guessing code is still quite shaky and should be improved.
processor.hh 5.36 KiB