Analyze correlated motions in MD trajectories with only a few lines of Python code.
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Project description
MDEntropy is a python library that allows users to perform information-theoretic analyses on molecular dynamics (MD) trajectories. It includes methods to calculate:
- Bias-Corrected Entropy
- Conditional Entropy
- Mutual Information
- Normalized Mutual Information
- Conditional Mutual Information
- Normalized Conditional Mutual Information
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| Filename, size & hash SHA256 hash help | File type | Python version | Upload date |
|---|---|---|---|
| mdentropy-0.2.tar.gz (3.6 kB) Copy SHA256 hash SHA256 | Source | None |
