Greg Landrum
d8c49e6dab
Code cleanups from PVS/Studio ( #2531 )
...
* first round of cleanups based on PVS-studio suggestions
* a couple more
* a few more cleanups
* another round of cleanups
* undo one of those cleanups
we want the integer rounding behavior here
* add a comment to make that clear
* Fix for filter catalog PRECONDITION redundancy
2019-07-13 07:25:37 +02:00
Ric
be3170d0d5
Mem errors clean up ( #2305 )
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* fix test leaks
* fix "invalid read" when casting Query to EqualityQuery
* fix error cleanup in SMILES/SMARTS parsers
* SMILES/SMARTS parser fix updated *.cmake
* fix error cleanup in SLN parser
* SLN parser updated *.cmake
* updated suppressions
* update loop in sln bison
2019-03-08 05:39:59 +01:00
Greg Landrum
2738c35178
Fixes #1903 ( #1971 )
...
* Fixes #1903
* update SWIG bindings too
2018-07-25 09:14:17 +02:00
Paolo Tosco
c08ea49bda
- enable building DLLs on Windows ( #1861 )
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* - enable building DLLs on Windows
* - export.h and test.h are now auto-generated by CMake
2018-05-16 08:42:41 +02:00
Greg Landrum
e08e0d16d8
first pass, using google style
2015-11-14 14:58:11 +01:00
Greg Landrum
1567ec4462
add getFullDescription() to Query;
...
Fixes #287
2014-05-22 15:18:07 +02:00
Greg Landrum
b7f5681ed0
make query description handling more efficient
2013-12-14 09:31:41 +01:00
Greg Landrum
dfe985c5cd
clear up some compiler warnings
2013-09-29 15:14:09 +02:00
Greg Landrum
7fcf3c4be8
cleanup
2012-03-22 04:23:17 +00:00
Greg Landrum
a9e2447b28
another checkpoint; this seems to be working for the lipinksi and crippen descriptors
2012-02-25 05:38:09 +00:00
Greg Landrum
f3fbef45c5
update copyright statements
2010-09-26 17:04:37 +00:00
Greg Landrum
052ec66542
cleanups:
...
remove x bit from headers and sources;
remove a couple empty files from Code/GraphMol
2010-09-08 04:25:57 +00:00
Greg Landrum
849d0de339
support direct access to match and data funcs from queries
2008-02-26 18:05:17 +00:00
Greg Landrum
3e6cb74075
cleanup and documentation changes
2007-11-14 06:09:52 +00:00
Greg Landrum
75a79b6327
initial import
2006-05-06 22:20:08 +00:00
