Commit Graph

4 Commits

Author SHA1 Message Date
ajacoutot
1504961432 - update to openbabel-2.2.0
- gcc4 is needed to build this now

* improved force fields and coordinate generation, conformer searching,
enhanced plugins including molecular descriptors, filters, and
command-line transformations
* many formats improved or added, including CIF, mmCIF, Gaussian cube,
PQR, OpenDX cubes, and more
* improved developer API and scripting support
* many, many bugfixes
2008-08-20 16:08:11 +00:00
ajacoutot
7dbb038927 - update to version 2.1.1
(fixes for several important crashes)
2007-07-08 17:50:48 +00:00
ajacoutot
63db075793 - update to openbabel-2.1.0 final 2007-04-08 10:10:23 +00:00
ajacoutot
7262cc83c3 Import openbabel-2.1.0b4
Open Babel is a chemical toolbox designed to speak the many languages of
chemical data.  It's an open, collaborative project allowing anyone to
search, convert, analyze, or store data from molecular modeling,
chemistry, solid-state materials, biochemistry, or related areas.
[...]

ok steven@
2007-01-22 16:32:41 +00:00