Open rkurchin opened 3 years ago
On a slightly related note, the documentation may also need some reorganization.
renamed issue because realized we also need tests in the AtomGraph
tests that the keyword arguments work. Currently those are only tested in the utils tests for graph-building, but then when a semicolon got lost in the AtomGraph
constructor such that all keyword arguments accidentally became positional, it didn't break anything...
They also probably need to be reorganized a bit in light of the addition of the
FeaturizedAtoms
type...