Input format to mol_features

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 geemi725 closed 3 years ago

geemi725 commented 3 years ago

mol features takes in json file or adj matrix. Made more user friendly. Addresses Issue #250

pep8speaks commented 3 years ago

Hello @geemi725! Thanks for updating this PR. We checked the lines you've touched for PEP 8 issues, and found:

There are currently no PEP 8 issues detected in this Pull Request. Cheers! :beers: