RetroRules 2026: an expanded database combining biochemical and organic reaction templates for pathway discovery

RetroRules (https://retrorules.org) is an open resource of reaction templates, which are generic reaction representations that describe the atomic transformations underlying biochemical reactions. These templates are key to supporting metabolic pathway discovery, reaction prediction, and enzyme engineering. The 2026 release updates biochemical sources (MetaNetX, Rhea) and newly integrates organic chemistry reactions (USPTO), extending the scope of the database beyond enzymatic systems. The...