Espaloma | Anaconda.org

conda-forge / packages / espaloma 0.3.2

0

Extensible Surrogate Potential of Ab initio Learned and Optimized by Message-passing Algorithm 🍹 https://arxiv.org/abs/2010.01196

copied from cf-staging / espaloma

Info: This package contains files in non-standard labels.

To install this package run one of the following:
conda install conda-forge::espaloma
conda install conda-forge/label/espaloma_rc::espaloma