Hi,
On Tue, Sep 24, 2024 at 05:42:50PM +0200, Michael Banck wrote:
> On Tue, Sep 24, 2024 at 05:22:58PM +0300, Andrius Merkys wrote:
> > On 2024-09-24 17:09, David Lounsbrough wrote:
> > > I ran this inside my Docker container, it says the latest version of the
> > > package is installed:
> > >
>
Hi,
On Tue, Sep 24, 2024 at 05:22:58PM +0300, Andrius Merkys wrote:
> On 2024-09-24 17:09, David Lounsbrough wrote:
> > I ran this inside my Docker container, it says the latest version of the
> > package is installed:
> >
> > # apt-get -s install postgresql-16-rdkit
> > Reading package lists...
Hi David,
On 2024-09-24 17:09, David Lounsbrough wrote:
I ran this inside my Docker container, it says the latest version of the
package is installed:
# apt-get -s install postgresql-16-rdkit
Reading package lists... Done
Building dependency tree... Done
Reading state information... Done
postg
I ran this inside my Docker container, it says the latest version of the
package is installed:
# apt-get -s install postgresql-16-rdkit
Reading package lists... Done
Building dependency tree... Done
Reading state information... Done
postgresql-16-rdkit is already the newest version (202303.3-3.pgd
Hi,
On 2024-09-24 16:30, David Lounsbrough wrote:
Hi, I am simply standing up a Postgres database with this package
installed in it. This is the entire Dockerfile I am using:
```
FROM postgres:16 AS postgres-env
RUN apt-get update && \
apt-get install -yq postgresql-16-rdkit && \
apt-ge
Hi, I am simply standing up a Postgres database with this package installed
in it. This is the entire Dockerfile I am using:
```
FROM postgres:16 AS postgres-env
RUN apt-get update && \
apt-get install -yq postgresql-16-rdkit && \
apt-get clean
```
I get the same results when building it fre
Control: tags -1 + moreinfo
Hi David,
On Thu, 25 Jul 2024 12:05:55 -0500 David Lounsbrough
wrote:
To reproduce, I simply ran this Dockerfile:
FROM postgres:16 AS postgres-env
RUN apt-get update && \
apt-get install -yq postgresql-16-rdkit && \
apt-get clean
Then when I try to build a
I see, thanks for the information. From the linked bug it sounds like it
may be available in the future. I'll defer to you on whether to keep this
bug open or to close it.
Thanks!
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
I realized RDK_BUILD_INCHI_SUPPORT is already set in the build script:
https://salsa.debian.org/debichem-team/rdkit/-/blob/master/Scripts/create_deb_packages.sh?ref_type=heads#L9.
Perhaps there is something else then that is causing the issue.
To reproduce, I simply ran this Dockerfile:
FROM po
Package: postgresql-16-rdkit
Severity: normal
Dear Maintainer,
I wanted to ask if there's a reason that `inchi` support is not enabled for
this package.
I believe it is as simple as adding `RDK_BUILD_INCHI_SUPPORT=ON` to the cmake
command:
https://salsa.debian.org/debichem-team/rdkit/-/blob/m
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