Retrosynthesis prediction using an end-to-end graph generative architecture for molecular graph editing

Name: Retrosynthesis prediction using an end-to-end graph generative architecture for molecular graph editing
Creator: figshare
Published: 2023-05-26T07:02:28+08:00

DataCite Commons2023-05-26 更新2024-08-18 收录

逆合成预测

图神经网络

数据链接：

https://springernature.figshare.com/articles/dataset/Retrosynthesis_prediction_using_an_end-to-end_graph_generative_architecture_for_molecular_graph_editing/22649758/1 数据链接链接失效反馈

官方服务：

资源简介：

The USPTO-50k dataset and the trained Graph2Edits model for retrosynthesis prediction.

提供机构：

figshare

创建时间：

2023-05-26

Retrosynthesis prediction using an end-to-end graph generative architecture for molecular graph editing

资源简介：

相关数据集