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Re: ChemmineOB is using private interface of openbabel (rand.h)



Dear Andreas and Dirk,

Thanks for reporting this issue. I am CC'ing Kevin Horan on this email. He has been working on quite a few updates for ChemmineOB including support for OpenBabel 3. 

Kevin: could you please let Andreas and Dirk know...

Thanks,

Thomas

On Fri, Mar 27, 2020 at 6:44 AM Andreas Tille <tille@debian.org> wrote:
Hi Dirk,

On Fri, Mar 27, 2020 at 07:16:29AM -0500, Dirk Eddelbuettel wrote:
>
> I ran into that a few days ago. The version of ChemnineOB that is on the repo
> requires OpenBabel 2, we have version 3.  See
>   https://github.com/girke-lab/ChemmineOB/issues/21
> A new version should be forthcoming.

Thanks a lot for the very helpful information

    Andreas.

--
http://fam-tille.de


--
Thomas Girke, Ph.D.
Professor of Bioinformatics
1207F Genomics Building
University of California
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