Commit Graph

8 Commits

Author SHA1 Message Date
Greg Landrum
e08e0d16d8 first pass, using google style 2015-11-14 14:58:11 +01:00
Greg Landrum
f3fbef45c5 update copyright statements 2010-09-26 17:04:37 +00:00
Greg Landrum
20096c76a9 refactoring of the BitVect interface to make capitalization consistent
w/ the rest of the RDKit. i.e.: SetNumBits -> setNumBits
2010-05-30 15:15:46 +00:00
Greg Landrum
7f0c2c05fc remove lapack from the jamfiles 2009-10-31 06:09:20 +00:00
Greg Landrum
d73c892179 add a couple of things for faster similarity searching 2008-12-08 14:26:19 +00:00
Greg Landrum
375beb44ed add some atom-pair functionality. This needs testing. 2008-04-12 14:58:43 +00:00
Greg Landrum
5ad2aee617 molSubstructCount had the argument order wrong and wasn't using recursive smarts 2008-01-12 06:42:10 +00:00
Greg Landrum
d6c541d0fe added 2007-11-22 18:10:21 +00:00