Commit Graph

8 Commits

Author SHA1 Message Date
Greg Landrum
2fdfc3b9e4 - speed up Dice similarity between SparseIntVects (a lot)
- add bulk Dice similarity for SIVs to wrapper
- speed up bulk Dice similarity for bit vects
- test a bit more
2008-04-15 05:19:48 +00:00
Greg Landrum
7402b6639f two more small cleanups 2008-02-16 07:24:46 +00:00
Greg Landrum
1d248607c1 GraphMol/Descriptors:
- fix a boundary condition problem
 - clean up some compiler warnings
 - translate exceptions
2007-10-11 16:49:55 +00:00
Greg Landrum
93834a90bd remove support for the useAbs function;
add bounds support on the dice metric
2007-10-05 15:35:11 +00:00
Greg Landrum
0ab0653c18 move DiceSimilarity code into c++ 2007-10-04 03:34:06 +00:00
Greg Landrum
67f7dab587 fix a problem with __len__ in python (can't do it if we return a Long);
wrap GetLength() instead;
add getNonzeroElements()
2007-09-28 03:45:03 +00:00
Greg Landrum
7726cb9d8a getting close to right here; still needs windows testing 2007-09-23 06:54:37 +00:00
Greg Landrum
1fa8cd321b add SparseIntVect in both c++ and Python
This still needs windows testing.
2007-09-22 18:49:37 +00:00