Greg Landrum
|
65d1d8d63b
|
we should be able to generate mol files even without reasonable conformers
|
2008-02-29 07:47:16 +00:00 |
|
Greg Landrum
|
a788e29511
|
merge the changes from the CanonicalizerRework30Nov branch in.
The changes are revs 451:498.
|
2008-01-30 14:53:04 +00:00 |
|
Greg Landrum
|
66ec16dedf
|
Fix and test sf.net bug 1725068:
http://sourceforge.net/tracker/index.php?func=detail&aid=1725068&group_id=160139&atid=814650
|
2007-06-06 17:25:08 +00:00 |
|
Greg Landrum
|
db1b02febf
|
fix and test for sf.net issue 1718794
http://sourceforge.net/tracker/index.php?func=detail&aid=1718794&group_id=160139&atid=814650
|
2007-05-14 17:27:59 +00:00 |
|
Greg Landrum
|
9bd4c59606
|
substantial optimization of SD/mol file parsing;some reformattig
|
2007-03-20 21:06:37 +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 |
|