/tools/AdKGromacsTutorial

AdKGromacsTutorial

Becksteinlab/AdKGromacsTutorial

GitHub
tutorialmolecular-dynamicsprotein
10 stars7 forksShellWebsiteAdded February 8, 2026
summary

The AdKGromacsTutorial repository offers a comprehensive guide for performing molecular dynamics simulations of the adenylate kinase enzyme using Gromacs. It includes steps for system setup, energy minimization, equilibration, and trajectory visualization, making it a valuable resource for researchers in molecular dynamics.

description

Basic tutorial for running and analyzing a Gromacs MD simulation of AdK

topics

gromacstutorialmolecular-dynamics-simulation

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