Nils is absolutely correct about the Daylight fingerprint. For the RDKit fingerprint there is (still) no official citation.
-greg On Fri, Feb 15, 2019 at 1:21 PM Nils Weskamp <nils.wesk...@gmail.com> wrote: > Dear Mario, > > for the original Daylight fingerprints, I would cite the "Daylight Theory > Manual" at > > http://www.daylight.com/dayhtml/doc/theory/ > > Best, > Nils > > > > On Fri, Feb 15, 2019 at 11:48 AM Mario Lovrić <mario.lovri...@gmail.com> > wrote: > >> Dear all, >> >> I am looking for the original citation of the RDKit fingerprint. >> >> The documentation says: >> RDKit a Daylight-like fingerprint based on hashing molecular subgraphs >> >> Is there a literature source? >> >> The Daylight website didn't make it clear. >> http://www.daylight.com/meetings/summerschool01/course/basics/fp.html >> >> >> Thanks >> >> -- >> Mario Lovrić >> _______________________________________________ >> Rdkit-discuss mailing list >> Rdkit-discuss@lists.sourceforge.net >> https://lists.sourceforge.net/lists/listinfo/rdkit-discuss >> > _______________________________________________ > Rdkit-discuss mailing list > Rdkit-discuss@lists.sourceforge.net > https://lists.sourceforge.net/lists/listinfo/rdkit-discuss >
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