| Popis: |
Based on pollingat the OpenFF annual workshop in May 2021, audience members wereinterested in attending a dedicated session about benchmarking efforts. This session was held on September 1, 2021. Roughly the first hour is a presentation, and the second hour focuses on an interactivejupyter notebook [1]analyzing some selected outputs from the larger benchmarking effort[2]. [1]https://github.com/openforcefield/2021-benchmarking-workshop/tree/2021.08.31.0 [2]https://github.com/openforcefield/openff-benchmark/tree/2021.08.04.0 |
