- Article
RetroComposer: Composing Templates for Template-Based Retrosynthesis Prediction
- Chaochao Yan,
- Peilin Zhao,
- Chan Lu,
- Yang Yu and
- Junzhou Huang
The main target of retrosynthesis is to recursively decompose desired molecules into available building blocks. Existing template-based retrosynthesis methods follow a template selection stereotype and suffer from limited training templates, which pr...