Have a question?
Send enquiry
Message sent Close

Protein-Ligand

StemSkills Lab > Protein-Ligand
Protein-Ligand MD Simulation in GROMACS: A Step-by-Step Tutorial for Beginners
27
Jun

Turn a docked pose into a real protein-ligand trajectory in GROMACS. Build the ligand topology, solvate, equilibrate, and run. Start your MD project.

Posted in: Molecular Modeling ,
Tags: CGenFF , Computational Biology , Drug Design , GROMACS , Molecular Dynamics , Protein-Ligand ,