Discussion:
[Rdkit-discuss] Is there a way to cite RDKit (in a paper?)
JP
2011-01-26 10:53:22 UTC
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Hi there,

Is there a way to cite RDKit in a paper? Like is there a paper describing
RDKit ?

Cheers
JP
Greg Landrum
2011-01-26 10:58:13 UTC
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Dear JP,
Post by JP
Hi there,
Is there a way to cite RDKit in a paper?  Like is there a paper describing
RDKit ?
At this point there's no publication describing the RDKit, so the
citation we normally use is:
RDKit: Open-source cheminformatics; http://www.rdkit.org

Best Regards,
-greg
JP
2011-01-26 11:24:28 UTC
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So using \bibliographystyle{IEEEtran} my entry looks like:

@electronic{rdkit,

author = {Greg Landrum},

title = {RDKit: Open-source cheminformatics},

url ={http://www.rdkit.org}

}


(Note: if you are using another bibtex style - you'd probably have to change
@electronic to @online, @www or @webpage - first one which works)
Post by Greg Landrum
Dear JP,
Post by JP
Hi there,
Is there a way to cite RDKit in a paper? Like is there a paper
describing
Post by JP
RDKit ?
At this point there's no publication describing the RDKit, so the
RDKit: Open-source cheminformatics; http://www.rdkit.org
Best Regards,
-greg
Greg Landrum
2011-01-26 11:46:08 UTC
Permalink
Hi JP,
Post by JP
Post by JP
@electronic{rdkit,
author = {Greg Landrum},
title = {RDKit: Open-source cheminformatics},
url ={http://www.rdkit.org}
}
(Note: if you are using another bibtex style - you'd probably have to change
@electronic to @online, @www or @webpage - first one which works)
I don't think it's appropriate to include the author field. There have
been contributions to the RDKit, in the form of code, suggestions, bug
reports, ideas, etc. from many people.

Best,
-greg

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