Hello, After creating an atom using the OBBond constructor, is it possible to set the real valence as it is defined in chemistry (e.g., carbon in acetylene would have a valence of 4 and not of 2 like in Openbabel)? I know it's possible to get this valence from an atom that already exists using OBAtom.BOSum(), but that does not help when I am trying to set it.
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