Skip to content

Is stereochemistry supported? #2

@rapodaca

Description

@rapodaca

I recently found Helium and it looks very useful, especially with its SMIRKS support.

However, in using the Python interface, it looks like stereochemistry isn't supported:

>>> smiles = Smiles()
>>> m = Molecule()
>>> smiles.read('C[C@H](Cl)CCN', m)
True
>>> smiles.write(m)
'CC(Cl)CCN'

Is this just the Python interface, or does stereochemistry remain to be implemented?

Metadata

Metadata

Assignees

No one assigned

    Labels

    No labels
    No labels

    Projects

    No projects

    Milestone

    No milestone

    Relationships

    None yet

    Development

    No branches or pull requests

    Issue actions