BODIPYs
收藏NIAID Data Ecosystem2026-03-12 收录
下载链接：
https://figshare.com/articles/dataset/BODIPYs/16529214
下载链接
链接失效反馈官方服务：
资源简介：
The BODIPYs dataset contains (gas phase) DFT level geometries and TDDFT level properties of the S0 → S1 first electronic excited state of 77,412 molecules derived from the BODIPY dye by combinatorial substitution.
For more details see: https://moldis-group.github.io/BODIPYs/
Contact: ramakrishnan@tifrh.res.in, raghu.rama.chem@gmail.com
创建时间：
2021-09-08
