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Adds replaceCore function that takes a matchVect (#1013)
* Adds replaceCore function that takes a matchVect * Fixes error reporting, adds tests * Switches PRECONDITION to ValueError exceptions * Fixes MatchVectType annoyance in swig. Don't know why this is necessary. * Silences warnings * Adds working doctests and better explanations.
This commit is contained in:
committed by
Greg Landrum
parent
ddb13ecc16
commit
71a0ae32b2
@@ -33,6 +33,8 @@
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%{
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#include <GraphMol/ChemTransforms/ChemTransforms.h>
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// Fixes annoying compilation namespace issue
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typedef RDKit::MatchVectType MatchVectType;
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%}
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%newobject deleteSubstructs;
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