PaRoutes: a framework for benchmarking retrosynthesis route predictions
收藏NIAID Data Ecosystem2026-03-13 收录
数据链接：
官方服务：
资源简介：
PaRoutes is a framework for benchmarking multi-step retrosynthesis methods, i.e. route predictions. It provides: A curated reaction dataset for building one-step retrosynthesis models Two sets of 10,000 routes Two sets of stock molecules to use as stop-criterion for the search Homepage: https://github.com/MolecularAI/PaRoutes
创建时间：
2022-02-25
