Re: [Rdkit-discuss] PostgreSQL in Windows 7

2016-07-21 Thread Riccardo Vianello
Hi Gonzalo, On Thu, Jul 21, 2016 at 11:26 AM, Gonzalo Colmenarejo < [email protected]> wrote: > I'm trying to install PostgreSQL and the corresponding RDKit cartridge in > a Windows 7 laptop with Anaconda with Python 2.7 by running > > conda install -c https://conda.binstar.org/rdkit

[Rdkit-discuss] PostgreSQL in Windows 7

2016-07-21 Thread Gonzalo Colmenarejo
Hi, I'm trying to install PostgreSQL and the corresponding RDKit cartridge in a Windows 7 laptop with Anaconda with Python 2.7 by running conda install -c https://conda.binstar.org/rdkit rdkit-postgresql However, I get the following error: Package missing in current win-64 channels. Do you kno

Re: [Rdkit-discuss] postgresql cartridge and fingerprints

2015-03-17 Thread Michal Krompiec
Hi Greg, Thanks. I haven't started tests yet, so we'll see. Best wishes, Michal On 17 Mar 2015 15:08, "Greg Landrum" wrote: > Hi Michal, > > On Tue, Mar 17, 2015 at 3:02 PM, Michal Krompiec < > [email protected]> wrote: > >> Hello, >> >> I understand that the index for substructure search

Re: [Rdkit-discuss] postgresql cartridge and fingerprints

2015-03-17 Thread Greg Landrum
Hi Michal, On Tue, Mar 17, 2015 at 3:02 PM, Michal Krompiec wrote: > Hello, > > I understand that the index for substructure searching is created by, > for example: > > create index molidx on mols using gist(m) > > where m is the molecule column in mols table. Is this correct? > yes, that's cor

[Rdkit-discuss] postgresql cartridge and fingerprints

2015-03-17 Thread Michal Krompiec
Hello, I understand that the index for substructure searching is created by, for example: create index molidx on mols using gist(m) where m is the molecule column in mols table. Is this correct? How do I select the type of fingerprint used for the index? I just suspect that my dataset may requi

Re: [Rdkit-discuss] postgresql

2011-06-01 Thread TJ O'Donnell
There are binaries available at http://www.postgresql.org/download/ and a nice wiki at http://wiki.postgresql.org/wiki/Main_Page The postgres community is great - check out the mailing lists at http://www.postgresql.org/community/ TJ - TJ O'Donnell, Ph.D. President, gNova Inc. t...

Re: [Rdkit-discuss] postgresql

2011-06-01 Thread Peter Schmidtke
Hey Paul, hope you are fine ;) What system/architecture are you using? ++ Peter On 01/06/2011, at 15:31, [email protected] wrote: > > dear rdkitters, > > i would like to install postgresql/sqlite. could anyone point to a good > tutorial on how to set-up such a system? i know how to

Re: [Rdkit-discuss] postgresql

2011-06-01 Thread JP
I did this a while back (Postgres 9.0.3). Download the source and there is an excellent INSTALL txt file in the tar file with all the instructions. Here is the "short version" (head -50 INSTALL) ./configure gmake su gmake install adduser postgres mkdir /usr/local/pgsql/data chown postgres /usr/l

[Rdkit-discuss] postgresql

2011-06-01 Thread Paul . Czodrowski
dear rdkitters, i would like to install postgresql/sqlite. could anyone point to a good tutorial on how to set-up such a system? i know how to use google, but maybe you guys are faster... :) paul This message and any attachment are confidential and may be privileged or otherwise protected from