Email Archive: rdkit-discuss (read-only)

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Topic Topic Starter Thread
Posts		 Last Post
  Re: [Rdkit-discuss] Tversky similarity Gonzalo Colmenarejo-Sanchez <Gonzalo.Colmenarejo@gs...> 3 2013-05-23 12:33
  Re: [Rdkit-discuss] Problem with a chiral tag assignment greg landrum <greg.landrum@gm...> 2 2013-05-17 18:28
  [Rdkit-discuss] Switching to git/github as the primary source code repository for the RDKit Greg Landrum <greg.landrum@gm...> 1 2013-05-17 03:41
  Re: [Rdkit-discuss] Ring Info for molecules Syeda Sabrina <sus364psu@gm...> 2 2013-05-15 22:41
  Re: [Rdkit-discuss] sudo apt-get install python-rdkit not working JP <jeanpaul.ebejer@in...> 6 2013-05-15 10:20
  Re: [Rdkit-discuss] Fwd: PostGres cartridge Nicholas Firth <Nicholas.Firth@ic...> 3 2013-05-15 08:47
  Re: [Rdkit-discuss] preserving chirality of input molecule in achiral reaction Greg Landrum <greg.landrum@gm...> 2 2013-05-15 03:56
  [Rdkit-discuss] chemicalite Riccardo Vianello <riccardo.vianello@gm...> 1 2013-05-11 14:42
  Re: [Rdkit-discuss] bug maybe Syeda Sabrina <sus364psu@gm...> 3 2013-05-08 15:36
  Re: [Rdkit-discuss] New module for RDKit - PANDAS integration Markus Hartenfeller <markus.hartenfeller@mo...> 11 2013-05-08 12:47
  Re: [Rdkit-discuss] New module for RDKit - PANDAS integration Markus Hartenfeller <markus.hartenfeller@mo...> 8 2013-05-07 08:02
  [Rdkit-discuss] Ubuntu rdkit package works in 12.04 and 12.10 hari jayaram <harijay@gm...> 1 2013-05-05 02:04
  Re: [Rdkit-discuss] Building rdkit on Ubuntu 12.10 hari jayaram <harijay@gm...> 5 2013-05-03 19:36
  Re: [Rdkit-discuss] MMP analysis - active vs. inactive compounds George Papadatos <gpapadatos@gm...> 2 2013-05-03 11:16
  Re: [Rdkit-discuss] Using EmbedPharmacophore Greg Landrum <greg.landrum@gm...> 2 2013-05-02 03:36
  Re: [Rdkit-discuss] InChI strings from molfiles - stereo perception. Jan Holst Jensen <jan@bi...> 3 2013-05-01 12:03
  [Rdkit-discuss] topological torsions fingerprints bug in 2013.03.1 release Greg Landrum <greg.landrum@gm...> 1 2013-05-01 03:11
  Re: [Rdkit-discuss] [Rdkit-devel] 2013.03 (Q1 2013) RDkit release Gianluca Sforna <giallu@gm...> 2 2013-04-27 13:35
  Re: [Rdkit-discuss] PAINS Greg Landrum <greg.landrum@gm...> 5 2013-04-26 04:14
  Re: [Rdkit-discuss] PAINS Simon Saubern <Simon.Saubern@cs...> 1 2013-04-25 23:33
  Re: [Rdkit-discuss] any experience "boost::bad_any_cast" Greg Landrum <greg.landrum@gm...> 9 2013-04-25 04:10
  Re: [Rdkit-discuss] Coding convention/style? Gianluca Sforna <giallu@gm...> 3 2013-04-24 16:23
  Re: [Rdkit-discuss] RDKit cartridge speed issue Greg Landrum <greg.landrum@gm...> 2 2013-04-24 03:52
  [Rdkit-discuss] Beta of Q1 2013 release Greg Landrum <greg.landrum@gm...> 1 2013-04-18 03:13
  [Rdkit-discuss] publication using RDKit Igor Filippov [Contr] <igor.filippov@ni...> 2 2013-04-17 16:17
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