45 citations · 89 across the 3 of their papers we have counts for
3 papers
q-bio.QM2021★ 2 cited
BioNavi-NP: Biosynthesis Navigator for Natural Products
Shuangjia Zheng, Tao Zeng, Chengtao Li +4
Nature, a synthetic master, creates more than 300,000 natural products (NPs) which are the major constituents of FDA-proved drugs owing to the vast chemical space of NPs. To date,…
cs.LG2020★ 42 cited
Retro*: Learning Retrosynthetic Planning with Neural Guided A* Search
Binghong Chen, Chengtao Li, Hanjun Dai +1
Retrosynthetic planning is a critical task in organic chemistry which identifies a series of reactions that can lead to the synthesis of a target product. The vast number of possib…
cs.LG2020★ 45 cited
Retrosynthesis Prediction with Conditional Graph Logic Network
Hanjun Dai, Chengtao Li, Connor W. Coley +2
Retrosynthesis is one of the fundamental problems in organic chemistry. The task is to identify reactants that can be used to synthesize a specified product molecule. Recently, com…