Retro-fallback: retrosynthetic planning in an uncertain world
paper
Official version Version I consider authoritative
Summary
An algorithm to suggest synthesis routes for molecules using reaction uncertainty.
My contribution
Co-lead of the project and primary developer of the algorithm. Details in the paper’s author contribution section.
Thoughts
(as of 2023-11-24)
This is ongoing work so I cannot really offer a “retrospective”, but barring significant advancements in single-step reaction prediction I think retro-fallback could be really useful in practice!