遇见数据集

spec2struct resources

收藏
Zenodo2025-01-13 更新2026-05-26 收录
官方服务:

资源简介:

Unzip the files with this command tar -xvzf molbind.tar.gz This is the supplementary information for the spec2struct pipeline that has been built using the MoleculeBind framework. The source code for MoleculeBind can be found at src/ and also on GitHub, while the scripts for spec2struct can be found at experiments/structure_elucidation/*.

提供机构:
Zenodo
创建时间:
2024-11-22
二维码
社区交流群
二维码
科研交流群
商业服务