/tools/mdCATH

mdCATH

compsciencelab/mdCATH

56 stars4 forksJupyter NotebookAdded February 4, 2026
summary

The mdCATH repository contains scripts and notebooks for generating and analyzing the mdCATH dataset, which is focused on molecular dynamics trajectories. It provides tools for users to visualize and work with the dataset, making it useful for research in computational biophysics.

description

This repository houses all the scripts and notebooks utilized for generating, analyzing, and validating the mdCATH dataset. Some user examples are also available.

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