Add Tutorial for Analyzing MD Trajectories Using Deeptime #294
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This pull request adds a Jupyter Notebook tutorial (
md_trajectory_tutorial.ipynb
) demonstrating how to analyze molecular dynamics (MD) trajectories using Deeptime library. The tutorial covers loading trajectories, performing Time-lagged Independent Component Analysis (TICA), and visualizing results.Changes Made
md_trajectory_tutorial.ipynb
with detailed instructions and code examples.Purpose
The purpose of this pull request is to provide a comprehensive guide for users interested in leveraging Deeptime for MD trajectory analysis. This tutorial enhances the repository's documentation and educational resources.
Checklist
Author : Jilsy Xavier
[email protected]