How to install RDKit cartridge?
The instructions here show how to use it, but not how to install it.
http://www.rdkit.org/docs/Cartridge.html
I have RDKit and PostgreSQL installed from the corresponding Debian
packages, but alas no cartridge :-(
Tim
Dear Tim,
please take a look at this README in your installation:
your RDKit folder/Code/PgSQL/rdkit/README
It essentially boils down to this:
cd $RDBASE/Code/PgSQL/rdkit
$ make
$ sudo make install
$ make installcheck
(only the second step has to be performed as root)
Kind regards,
Axel
On
Hi Tim,
I'm not sure about this, but I think that in order to use the cartridge you
have to build RDKit and cartridge from source.
Regards,
Christos Kannas
Sent from my Galaxy Note 4.
On 24 Apr 2015 13:47, Tim Dudgeon tdudgeon...@gmail.com wrote:
Is it possible when using the packages?
I'm
Is it possible when using the packages?
I'm trying to get a reproducible build process so prefer not to have to
build from sources.
Tim
On 24/04/2015 13:29, Axel Pahl wrote:
The instructions below appliy to the RDKit installation from source
and are probably not applicable to the Debian
The instructions below appliy to the RDKit installation from source and
are probably not applicable to the Debian package, sorry for generating
confusion.
Kind regards,
Axel
On 04/24/2015 02:24 PM, Axel Pahl wrote:
Dear Tim,
please take a look at this README in your installation:
your
Hi Tim,
I don't think the cartridge is made available as part of the debian
packaging. Gianluca includes it as part of his fedora packages (
https://copr.fedoraproject.org/coprs/giallu/rdkit/) but I believe that it's
not there for debian. You might try asking on the debichem list (
Matthew,
On Fri, Apr 24, 2015 at 11:43 PM, Matthew Lardy mla...@gmail.com wrote:
I am trying to open and write compressed sd files with the Java wrappers.
I know, and have, been able to do this in Python but has anyone cracked how
to read and write sdf.gz files in Java?
After googling
Hi all,
I am trying to open and write compressed sd files with the Java wrappers. I
know, and have, been able to do this in Python but has anyone cracked how
to read and write sdf.gz files in Java?
Thanks in advance!
Matthew
8 matches
Mail list logo
