Search Results for author: Yinan Shu

Found 1 papers, 1 papers with code

Beyond MD17: the reactive xxMD dataset

1 code implementation22 Aug 2023 Zihan Pengmei, Junyu Liu, Yinan Shu

We show that the xxMD dataset involves diverse geometries which represent chemical reactions.

Benchmarking

Cannot find the paper you are looking for? You can Submit a new open access paper.