18 Commits

Author	SHA1	Message	Date
Greg Landrum	e51d2c1020	Fixes #118	2013-10-05 16:19:02 +02:00
Greg Landrum	d80ab78f70	initial pass at this	2013-07-15 17:04:15 +02:00
Greg Landrum	c36547010a	Fix #64	2013-07-09 05:40:55 +02:00
Greg Landrum	9ff479838c	fix and test issue 264	2012-11-17 06:49:38 +00:00
Greg Landrum	4b40a7d3f4	a bit more robustification around issue 3525000b	2012-05-09 13:41:22 +00:00
Greg Landrum	03ecdbc1cc	fix and test issue 3525000	2012-05-09 13:13:46 +00:00
Greg Landrum	5f85129f22	initial support for clang ... this is minor build-system variations and some code cleanup the python wrapper still needs cleanup and the sln stuff doesn't work at all under clang due to weirdness with boost::regex	2011-05-25 19:40:31 +00:00
Greg Landrum	f3fbef45c5	update copyright statements	2010-09-26 17:04:37 +00:00
Greg Landrum	0b94555f88	fix (and test) potential crashing bug ... with use of close() in SDWriters	2010-08-30 05:00:58 +00:00
Greg Landrum	3f08f58208	add close() method to writers	2010-07-28 04:29:58 +00:00
Greg Landrum	73fccfd26f	add a few simple tests for the mol file parity handling	2009-01-21 06:05:13 +00:00
Greg Landrum	3c24365856	allow _Names to be left out of Smiles writer output (sf.net feature request 2039278)	2008-08-12 19:25:38 +00:00
Greg Landrum	96e8412e8d	support isomeric smiles from the SmilesWriter	2008-07-17 08:20:27 +00:00
Greg Landrum	28c3224c9b	MolFileParser: move the chirality setting inside the sanitization test ... FileParsers.vcproj: remove optimization (under vc++) for two files. This is a "fix" for what I believe to be a vc++ compiler bug. See issue 1607290 (http://sourceforge.net/tracker/index.php?func=detail&aid=1607290&group_id=160139&atid=814650) testMolWriter.cpp: update memory corruption test	2006-12-21 04:45:37 +00:00
Greg Landrum	47a62846e7	test for memory corruption	2006-12-17 15:32:48 +00:00
Greg Landrum	a023b862aa	support direct passing of streams	2006-11-19 06:46:58 +00:00
Greg Landrum	5d03333c22	setup svn keywords (should have done this before import... grn)	2006-05-06 22:54:39 +00:00
Greg Landrum	75a79b6327	initial import	2006-05-06 22:20:08 +00:00