AI retrosynthesis (Segler 2018)

Layer 2 — Chemistryin the retrosynthesis-strategy subtree

Segler-Preuss-Waller 2018 Monte-Carlo tree-search + neural-policy retrosynthesis; >80% success in random Reaxys targets; modern Chematica + IBM-RXN platforms.

Related concepts

Tree (graph-theoretic)

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