[Debichem-devel] Bug#983040: rdkit: doesn't ship with inchi support enabled

Michael Banck mbanck at debian.org
Thu Feb 18 13:27:16 GMT 2021


Package: rdkit
Severity: wishlist

Hi Francois,

On Thu, Feb 18, 2021 at 02:48:49PM +0900, Francois Berenger wrote:
> ---
> python3
> import rdkit
> from rdkit import Chem
> rdkit.Chem.INCHI_AVAILABLE
> # False
> ---
> 
> It would be nice if INCHI support is enabled
> when building rdkit for Debian.
> 
> If you point me to the bugtracker where I should report
> this (not found after 10min of searching...), I might report it there.

What you can do is email submit at bugs.debian.org (in BCC on this mail)
and use the above pseudo-headers, or use the reportbug tool available in
Debian.
 
> inchi is a pretty standard and common format for people dealing with
> chemical data.

Thanks, I'll look into it. However, the next Debian release is
feature-frozen already so not clear whether it will/can make it in.


Michael



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