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2b99ee477c19cb7bf4e826b386ab465cbc21bb2f
rdkit
/
Code
/
GraphMol
/
MolHash
History
Greg Landrum
93e8a746bf
Shrink the tautomeric zone for the v2 hash of things like imines (
#7502
)
2024-06-07 05:09:57 +02:00
..
Wrap
add HetAtomProtomerv2 (
#7253
)
2024-03-17 10:58:47 +01:00
catch_tests.cpp
Shrink the tautomeric zone for the v2 hash of things like imines (
#7502
)
2024-06-07 05:09:57 +02:00
CMakeLists.txt
make the catch tests build faster (
#5284
)
2022-05-17 04:39:33 +02:00
hashfunctions.cpp
Shrink the tautomeric zone for the v2 hash of things like imines (
#7502
)
2024-06-07 05:09:57 +02:00
mf.h
Add a CXSMILES option to the MolHash (
#5058
)
2022-03-03 16:00:38 +01:00
MolHash.h
Add a CXSMILES option to the MolHash (
#5058
)
2022-03-03 16:00:38 +01:00
nmmolhash.h
add HetAtomProtomerv2 (
#7253
)
2024-03-17 10:58:47 +01:00
normalize.cpp
Add a CXSMILES option to the MolHash (
#5058
)
2022-03-03 16:00:38 +01:00
