spib
State Predictive Information Bottleneck (SPIB)
- Author: Dedi Wang
- Free software: MIT license
- Documentation: https://spib.readthedocs.io.
What is it?
SPIB is a deep learning-based framework for dimension reduction and Markov model construction of MD trajectories. Please read and cite this manuscript when using SPIB: https://aip.scitation.org/doi/abs/10.1063/5.0038198. Here is an implementation of SPIB in Pytorch.
Credits
This package was created with Cookiecutter and the audreyr/cookiecutter-pypackage project template.