What are the Key Features of VMD for Catalysis Research?
Some key features of VMD that are particularly useful for catalysis research include:
Molecular Visualization: High-quality 3D graphics for visualizing molecular structures and dynamics. Trajectory Analysis: Tools for analyzing molecular dynamics trajectories, including distance measurements, angle calculations, and more. Scripting Capabilities: Built-in support for Tcl and Python scripting to automate tasks and customize analyses. Interactive Molecular Dynamics: Integration with molecular dynamics engines like NAMD, enabling real-time interaction with simulations.