[geoff[at]geoffhutchison.net: [Open Babel] Open Babel test file repository 2005-06-01

----- Forwarded message from Geoff Hutchison
 <geoff[at]geoffhutchison.net> -----
 From: Geoff Hutchison <geoff[at]geoffhutchison.net>
 Date: Wed, 1 Jun 2005 21:29:33 -0400
 To: openbabel-discuss list <openbabel-discuss[at]lists.sourceforge.net>,
 	openbabel-repository[at]lists.sourceforge.net
 Cc: cdk <cdk-devel[at]lists.sourceforge.net>,
 jmol-developers[at]lists.sf.net,
 	Warren DeLano <warren[at]delanoscientific.com>,
 	octet-devel[at]lists.sourceforge.net,
 	joelib <joelib-devel[at]lists.sourceforge.net>
 Subject: [Open Babel] (no subject)
 X-Mailer: Apple Mail (2.730)
 I'm happy to announce the release of the first public snapshot of the
 Open Babel test file repository 2005-06-01.
 This repository is an open resource for the purposes of test
 molecules, scripts and results in various chemical file formats.
 Releases are expected several times a year. The test set includes 39
 "canonical" files (including 20 formats) and 47 additional files.
 Many file formats have formal specifications (e.g., CML or PDB) but
 realistically, such specifications evolve, many files are passed
 around which do not adhere to these specifications, and without
 example reference files, the details of file format specifications
 are not always clear.
 Importantly these files can be used for testing import/export
 routines in many chemical programs, not just Open Babel. By providing
 such a resource, we hope that developers of chemical software will
 minimize bugs when translating chemical and molecular data between
 different file formats and different representations. Additionally,
 we hope to encourage the community of chemical software developers to
 support open, well-defined file formats to facilitate interconversion
 and collaboration in the chemical sciences.
 * For more information, check: <http://openbabel.sourceforge.net/
 repository/>
 * To download the release: <http://sourceforge.net/project/
 showfiles.php?group_id=40728&package_id=152710>
 * To discuss the release (openbabel-repository[at]lists.sourceforge.net):
   <http://sourceforge.net/mailarchive/forum.php?forum_id=45088>;
 Please consider contributing files: http://sourceforge.net/tracker/?
 atid=740158&group_id=40728&func=browse
 Cheers,
 -Geoff
 (Please distribute this announcement as you see fit to chemistry/
 cheminformtics software developers, etc.)
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