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Add MolEnumerator to C# (#6542)

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* Include enumerator in C# wrappers

* Add MolBundle to C# and create test
This commit is contained in:
Gareth Jones
2023-07-13 04:43:56 -06:00
committed by greg landrum
parent 7d824f5af4
commit 8fac924710
2 changed files with 52 additions and 0 deletions
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4
Code/JavaWrappers/csharp_wrapper/GraphMolCSharp.i
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@@ -159,6 +159,8 @@ typedef unsigned long long int uintmax_t;
%shared_ptr(RDKit::QueryAtom)
%shared_ptr(RDKit::QueryBond)
%shared_ptr(RDKit::QueryOps)
%shared_ptr(RDKit::MolBundle)
%shared_ptr(RDKit::FixedMolSizeMolBundle)
%shared_ptr(RDKit::MolSanitizeException)
%shared_ptr(RDKit::AtomSanitizeException)
%shared_ptr(RDKit::AtomValenceException)
@@ -206,6 +208,7 @@ typedef unsigned long long int uintmax_t;
%include "../QueryAtom.i"
%include "../QueryBond.i"
%include "../QueryOps.i"
%include "../MolBundle.i"
%include "../MonomerInfo.i"
%include "../PeriodicTable.i"
%include "../SanitException.i"
@@ -237,6 +240,7 @@ typedef unsigned long long int uintmax_t;
%include "../SubstructLibrary.i"
%include "../ScaffoldNetwork.i"
%include "../TautomerQuery.i"
%include "../MolEnumerator.i"
%include "../SubstanceGroup.i"
%include "../MolHash.i"
%include "../Abbreviations.i"