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
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Add to mapping example notebook code for writing GSD file #266

Closed whitead closed 3 years ago

hgandhi2411 commented 3 years ago

@geemi725 you can refer to traj_parser.py file in this commit.

geemi725 commented 3 years ago

Addressed and merged.