chn
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2011-01-25
Hi, I tried running this command "babel -ipdb fad_charged.pdb -omol
fad.mol" and the fad.mol file doesn't have the correct bond order for atom
37 and atom 49 (should be -1 instead of 2 respectively), and I suppose
that's why no properties were printed (should be -2 for the molecule)?
Thanks.