[Debichem-devel] Bug#1077055: Bug#1077055: postgresql-16-rdkit: inchi support not included in rdkit build

Andrius Merkys merkys at debian.org
Tue Jul 30 07:10:24 BST 2024


Hi David,

On 7/25/24 18:51, David Lounsbrough via Debichem-devel wrote:
> I wanted to ask if there's a reason that `inchi` support is not enabled for this package.

You can read more about the attempts to enable InChI support in rdkit in 
[1]. In short, inchi package in Debian seems incompatible with rdkit 
(too old, seemingly), and the newer versions have licensing issues.

[1] https://bugs.debian.org/cgi-bin/bugreport.cgi?bug=964773

Andrius



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