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    • Jason Swails's avatar
      Redo the way CHARMM PSF files are parsed. This should be much more robust in · 4b9221e3
      Jason Swails authored
      terms of supporting PSF files that don't really conform to the "standard" way
      that CHARMM prints them.
      
      The downside is that it relies on ! comment tags which I think are comments for
      CHARMM.  However, the use of !NATOM and !NBOND and other tags seem to be _much_
      more conserved than the general format of the PSF file across different dialects
      of PSFs.  So the current approach should be more flexible.
      4b9221e3
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