Open Leticia-maria opened 2 years ago
Yes, unfortunately mol to smiles is not implemented yet... https://github.com/mojaie/MolecularGraph.jl/issues/23
Could I submit a PR implementing it? @mojaie
Yes, I would be happy if you make a PR.
Yes, I would be happy if you make a PR.
@mojaie Please, could you assign me on this issue? I'm working to implement it
Hello, I've checked the documentation, but I haven't found any method that transforms mol to smiles, only smiles to mol.