Exclude bonded interactions from nlist in htf.compute_nlist based of a sparse exclusion list

ur-whitelab / hoomd-tf

A plugin that allows the use of Tensorflow in Hoomd-Blue for GPU-accelerated ML+MD

https://hoomd-tf.readthedocs.io

MIT License

30 stars 8 forks source link

Closed mehradans92 closed 3 years ago