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rdkit
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8b49988bbdaa5edea72ef5f30c8d8893a035fac2
rdkit
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Code
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GraphMol
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ChemTransforms
History
Greg Landrum
cfaea83d7d
optimizations for molecule construction
2012-08-27 04:52:27 +00:00
..
testData
fix and test issue 3453144
2011-12-13 04:56:56 +00:00
ChemTransforms.cpp
optimizations for molecule construction
2012-08-27 04:52:27 +00:00
ChemTransforms.h
minor cleanup to RWMol::insertMol; add combineMols to ChemTransforms
2012-07-10 04:00:46 +00:00
CMakeLists.txt
merge in a set of changes from Riccardo V. to install .h files as well;
2010-09-04 14:07:22 +00:00
test_list.py
now all tests pass here as well
2009-02-03 05:26:10 +00:00
testChemTransforms.cpp
minor cleanup to RWMol::insertMol; add combineMols to ChemTransforms
2012-07-10 04:00:46 +00:00