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Average Velocity#

The Average velocity analysis follows the mean velocity magnitude of a selected group along a path. It is useful for dynamical trajectories and for quickly spotting bursts of motion or unusually quiet regions.

Path Analyzer - Average velocity

Adding the plot#

  1. Open Path Analyzer.
  2. Choose Average velocity in Observable.
  3. Choose a Path.
  4. Define the Group to analyze.
  5. Click Add Velocity Series or Add Velocity Distribution.

Inputs#

  • One atom-containing selection is required.
  • The chosen path must expose velocity data for the selected atoms.

Views#

  • Velocity series: follow the mean velocity magnitude over the path.
  • Velocity distribution: inspect the sampled distribution.

Key equation#

For a selected atom set \(\mathcal{A}\), Path Analyzer computes the mean velocity magnitude at frame \(t\) as

\[ \bar{v}(t)=\frac{1}{|\mathcal{A}|}\sum_{a\in\mathcal{A}}\|\mathbf{v}_a(t)\| \]

Card settings#

  • Units can be switched after creation between Auto, pm/fs, A/ps, and m/s.

Tip

  • Use average velocity for trajectories with meaningful dynamical information.
  • Compare it with Average force when you want to connect driving forces and resulting motion.