Re: [Rdkit-discuss] Download the file of zdd.sdf.gz

gt; Fortunately you can try the example with any sdf file or sdf.gz file that > you have, you don't need that exact file. > > -greg > > > > > On Wed, Nov 6, 2019 at 10:49 PM Peng Yu wrote: > >> Hi, >> >> https://www.rdkit.org/docs/Cookbook.html#clustering-

[Rdkit-discuss] Download the file of zdd.sdf.gz

Hi, https://www.rdkit.org/docs/Cookbook.html#clustering-molecules I'd like to try the above example. Where can the file zdd.sdf.gz be downloaded? Thanks. -- Regards, Peng ___ Rdkit-discuss mailing list Rdkit-discuss@lists.sourceforge.net

[Rdkit-discuss] What is the difference between rdkit and openbabel?

Hi, It seems that rdkit and openbabel share some common functionality. Could anybody help me understand the difference between them? What is the best use of each tool? Thanks. -- Regards, Peng ___ Rdkit-discuss mailing list