Thanks, Paulo and Greg. Yup, that was the reference. Thanks!
Best, -P. On Wed, Aug 31, 2016 at 2:05 PM, Greg Landrum <[email protected]> wrote: > > > On Wed, Aug 31, 2016 at 7:48 PM, Peter S. Shenkin <[email protected]> > wrote: > >> >> This is a bit off-topic, but I can't think of where else to ask. I >> couldn't find it in a quick google search. >> >> Not that many years ago (4?) there was a paper from Novartis that used >> rdkit to predict chem. rxn. products. The appendix listed ca. 50 reactions >> in common use for drug discovery. It was in J. Med. Chem. >> >> Can someone supply the reference? >> > > I think you mean this one: http://pubs.acs.org/doi/abs/10.1021/ci200379p > > >> P.S. Is there a bibliography of published papers that used or referenced >> RDKit? >> > > Not that I'm aware of. One can always do this: https://scholar.google. > ch/scholar?q=RDKit, but a curated (and annotated) version would be much > more useful. > It would be a good thing to have on an RDKit wiki, if there ever were to > be such a thing again.[1] :-) > > -greg > [1] this would just require me to set it up, but there hasn't been a big > call from the community for such a thing > >
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