From: Stefan K. <ste...@eb...> - 2008-09-26 12:22:09
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> I still don't understand how atom types were causing the error when > the only change in Fingerprinter was traversal Neither do I. The reason could be the fingerprinter does aromaticity detection and this takes into account the atom type. Because the fingerprinter seems not to use atom type, but the aromaticity - but just guessing, really. > > ------------------------------------------------------------------- > Rajarshi Guha <rg...@in...> > GPG Fingerprint: D070 5427 CC5B 7938 929C DD13 66A1 922C 51E7 9E84 > ------------------------------------------------------------------- > Entropy isn't what it used to be. |