Skip to content

Commit

Permalink
Merge branch 'wangxy/v1.0.0-devel' of https://github.com/deepmodeling…
Browse files Browse the repository at this point in the history
…/DMFF into wangxy/v1.0.0-devel
  • Loading branch information
WangXinyan940 committed Nov 9, 2023
2 parents 4cb4de2 + ce67cfa commit 58c7a5f
Showing 1 changed file with 1 addition and 1 deletion.
2 changes: 1 addition & 1 deletion docs/user_guide/4.7OpenMMplugin.md
Original file line number Diff line number Diff line change
Expand Up @@ -6,7 +6,7 @@ OpenMM DMFF plugin was developed for [OpenMM](http://openmm.org) to incorporate
To utilize this plugin, you need to save your DMFF model using the `DMFF/backend/save_dmff2tf.py` script.
The `save_dmff2tf.py` script converts the DMFF model to a TensorFlow module using the experimental feature of JAX called [`jax2tf`](https://github.com/google/jax/blob/main/jax/experimental/jax2tf/README.md).
The integration of the saved TensorFlow module with the DMFF plugin is accomplished using [cppflow](https://github.com/serizba/cppflow) and the OpenMM C++ interface.
To install the DMFF plugin, please refer to the instructions provided in the [Readme](backend/openmm_dmff_plugin/README.md).
To install the DMFF plugin, please refer to the instructions provided in the [Readme](../../backend/openmm_dmff_plugin/README.md).


## 2. Save DMFF model with script `save_dmff2tf.py`
Expand Down

0 comments on commit 58c7a5f

Please sign in to comment.