Commit Graph

16 Commits

Author SHA1 Message Date
Geoffrey Hutchison
32e8d6d627 Merged changes from 2.0.1 fixes that were not already integrated into 2.1. 2006-04-19 15:37:47 +00:00
Geoffrey Hutchison
5732e175fa * scripts/*: Update scripting wrappers with SWIG 1.3.29. 2006-03-28 22:38:06 +00:00
Noel O'Boyle
8caaa288f5 Reverted rename of the created extension from _openbabel.so to openbabel.so. 2006-03-16 15:18:59 +00:00
Noel O'Boyle
75c680fdf4 Adding a simple test file. 2006-03-16 10:18:36 +00:00
Geoffrey Hutchison
b8d999409a * scripts/* : More changes to allow building, linking, and running
(again!) with current CVS tree.
2006-03-15 19:48:37 +00:00
Geoffrey Hutchison
ffa5441823 * scripts/*: Build updates for Perl and Python wrappers. 2006-03-14 00:47:39 +00:00
Noel O'Boyle
ce597aeb68 Modified setup.py to also install pyopenbabel. 2006-02-21 09:33:24 +00:00
Geoffrey Hutchison
f71b7c5d47 * scripts/perl/* : Added more unit tests, fixed bug with
case-sensitive filesystems, and problems with dynamic loading on
        Linux.

        * scripts/python/*: Updated to fix problem with dynamic loading on
        Linux.
2006-01-25 20:31:41 +00:00
Noel O'Boyle
4aaf2fbe41 Adding file format conversion. 2006-01-04 15:53:52 +00:00
Noel O'Boyle
a3a65728b5 setup.py can now find the relevant libraries, whereever they are! 2005-12-16 11:18:14 +00:00
Noel O'Boyle
417b79770f Added find_likely_directory to setup.py based on the same function in pydaylight's setup.py. Not yet finished, but the general idea is there. 2005-12-15 17:06:02 +00:00
Noel O'Boyle
47ac0166f8 Added GetVar() methods to pyopenbabel.py. 2005-12-09 09:22:46 +00:00
Noel O'Boyle
2edfaa096f Documented the design of the Atom class so far, and started on the Molecule class. 2005-12-07 17:13:43 +00:00
Noel O'Boyle
96461e3f02 Initial import of pyopenbabel.py, a more Pythonic interface to openbabel, and pyopenbabel.txt, where notes on design decisions should be added. 2005-12-07 11:23:49 +00:00
Noel O'Boyle
d6bb5750c9 Renamed the created extension from openbabel.so to _openbabel.so. 2005-12-07 11:18:08 +00:00
Geoffrey Hutchison
cbc4695bc0 Updated mainline with openbabel-new-framework branch. Will create a new openbabel-2-0-x release branch soon. 2005-11-18 00:53:15 +00:00