David Cosgrove
1604a8b738
Fix off-by-one error in Reduced Graph fingerprint bitstring. ( #8385 )
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* Fix off-by-one error in bitstring.
* Response to review.
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Co-authored-by: David Cosgrove <david@cozchemix.co.uk >
2025-04-07 13:20:19 +02:00
Eisuke Kawashima
11532089de
Run clang-format against cpp ( #4358 )
2021-10-20 04:25:27 +02:00
Paolo Tosco
f04a9c9a42
- switched to using std::vector<unsigned int> for isotopichs property ( #3878 )
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- switched to using std::vector<int> instead of std::list<int> for _ErGAtomTypes property
- added RegisterListConverter<std::vector<unsigned int>>
Co-authored-by: Paolo Tosco <paolo.tosco@novartis.com >
2021-03-05 16:37:43 +01:00
Paolo Tosco
f7c888844d
moved test.h from RDBoost to RDGeneral for consistency with export.h ( #2074 )
2018-10-11 17:35:23 -04:00
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
e37296d7c7
post review
2015-11-14 08:08:14 +01:00
Brian Kelley
54311dff9c
Suppresses warnings in tests
2015-10-18 16:09:58 -04:00
Greg Landrum
59b7f91102
add some testing
2015-09-11 11:22:45 +02:00
Greg Landrum
af92a112ac
seems to be working, needs tests
2015-09-11 11:21:43 +02:00
Greg Landrum
51ebc9da1e
backup commit
2015-09-11 11:21:43 +02:00
