aspuru-guzik-group/dionysus
For analysis of calibration, performance, and generalizability of probabilistic models on small molecular datasets. Paper on RSC Digital Discovery: https://pubs.rsc.org/en/content/articlehtml/2023/dd/d2dd00146b
PythonMIT
Stargazers
- 2019mohamedProteinea
- beangoben
- gabegomes
- GitHub30Osaka, Japan
- gokceuludoganIstanbul, Turkey
- holeungAtomwise
- HShokaku
- ianrinehartUniversity of Illinois at Urbana-Champaign
- kevingreenmanMIT
- longkunxulukeSamsung
- MartinElsElstner Analytics GmbH
- mileswhenETH Zürich
- mu-wangP&G
- puckvgEPFL
- Ryan-RhysFutureHouse Inc.
- ShenPaul
- shihchengliMIT