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Collective Variables (COLVARS) are an indispensable component of modern molecular simulations allowing one to execute enhanced sampling
and free energy calculations along complex reaction coordinates. The Collective Variables Dashboard allows for real-time, seamless
exploration of molecular structures and trajectories. It arises from the integration of the
COLVARS Module with VMD, augmented with a graphical interface
offering interactive workflows for the design and analysis of collective variables. The Dashboard allows a priori design of collective
variables for simulations as well as analysis of any type of simulation trajectories. In addition, it provides an efficient way to intuitively
explore the space of likely collective variables, validate them on existing data, and use the resulting collective variable definitions
directly for additional simulations. Finally, it visualizes the energies and forces to help analyze or plan simulations.
Learn more about the Dashboard in a recent article, through
a 5-minute video, or this lecture.