4 Commits

Author	SHA1	Message	Date
Greg Landrum	8127c85a91	[v2 API] SMILES/SMARTS parsers (#6203) ... * basic approach to v2api * does not work, backup commit * well, that now compiles * cleaner * more cleanup and testing * get the SWIG wrappers to build * swig wrappers now build * switch back to using references to default values * adjust to new catch version * move the implementation to v2 and call it from v1 * update the parameter object too * move debugParse down * a couple of review changes * make v2 naming consistent with Python	2024-01-19 17:17:51 +01:00
Greg Landrum	c757ea64b6	add support for replacements in smiles and smarts. ... remove SmilesToMol and SmartsToMol from RDKFuncs (they leaked) remove useless wrapper file (SmilesParseOps.i).	2011-07-07 05:45:31 +00:00
Greg Landrum	e2d9ed51b3	add svn props	2011-07-01 04:43:39 +00:00
Greg Landrum	c7ef21088b	add initial version of new swig wrappers	2011-04-07 05:22:00 +00:00