public void NeighboursInBlockForMultipleBondsIgnoringBondOrders()
{
string acpString = "C0C1C2C3C4 0:1(1),0:2(2),0:3(1),1:4(1),2:4(1),3:4(2)";
IAtomContainer ac = AtomContainerPrinter.FromString(acpString, builder);
AtomRefinable refinable = new AtomRefinable(ac, false, true);
IInvariant invariant = refinable.NeighboursInBlock(Set(1, 2), 0);
Assert.IsTrue(invariant is IntegerInvariant);
Assert.AreEqual(new IntegerInvariant(2), invariant);
}
public void NeighboursInBlockForSingleBonds()
{
string acpString = "C0C1C2C3 0:1(1),0:3(1),1:2(1),2:3(1)";
IAtomContainer ac = AtomContainerPrinter.FromString(acpString, builder);
AtomRefinable refinable = new AtomRefinable(ac);
IInvariant invariant = refinable.NeighboursInBlock(Set(0, 2), 1);
Assert.IsTrue(invariant is IntegerInvariant);
Assert.AreEqual(new IntegerInvariant(2), invariant);
}
