using GraphMolWrap; using Xunit; namespace RdkitTests { public class MolEnumeratorTest { [Fact] public void TestEnumerator() { var block = @" Mrv2008 07102308312D 0 0 0 0 0 999 V3000 M V30 BEGIN CTAB M V30 COUNTS 10 8 0 0 0 M V30 BEGIN ATOM M V30 1 C -4.2917 4.9984 0 0 M V30 2 C -5.6253 4.2284 0 0 M V30 3 C -5.6253 2.6883 0 0 M V30 4 C -4.2917 1.9183 0 0 M V30 5 C -2.958 2.6883 0 0 M V30 6 C -2.958 4.2284 0 0 M V30 7 * -3.6248 4.6134 0 0 M V30 8 Cl -3.6248 6.9234 0 0 M V30 9 * -5.6253 3.4583 0 0 M V30 10 Cl -7.2521 3.4583 0 0 M V30 END ATOM M V30 BEGIN BOND M V30 1 1 1 2 M V30 2 2 2 3 M V30 3 1 3 4 M V30 4 2 4 5 M V30 5 1 5 6 M V30 6 2 1 6 M V30 7 1 7 8 ENDPTS=(2 1 6) ATTACH=ANY M V30 8 1 9 10 ENDPTS=(2 2 3) ATTACH=ANY M V30 END BOND M V30 END CTAB M END "; var mol = RWMol.MolFromMolBlock(block); var bundle = RDKFuncs.enumerate(mol); Assert.Equal(4U, bundle.size()); } } }