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degiacom authored Sep 13, 2024
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#### Analysis examples

* `analysis_example.py`: minimal example of analysis of trained neural network. This script operates on the content of the `data` and `xbb_foldingnet_checkpoints` folders. Note that more detailed explanations on analysis are available on our [molearn notebooks](https://github.com/Degiacomi-Lab/molearn_notebook)
* `interpolation_example.py`: this example demonstrates how to generate interpolations between two positions in the latent space in two ways (1) as a straight line or (2) using the A* shortest path algorithm on a DOPE score landscape.

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