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Average Force#

The Average force analysis follows the mean force magnitude on a selected group along a path. It is useful for spotting strained regions, strongly driven motions, or frames where the system experiences unusually large forces.

Path Analyzer - Average force

Adding the plot#

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

Inputs#

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

Views#

  • Force series: follow the mean force magnitude over the path.
  • Force distribution: inspect the distribution of sampled force magnitudes.

Key equation#

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

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

Card settings#

  • Units can be switched after creation between Auto, pN, and nN.

Tip

  • Use a focused selection when you care about one interface, motif, or active site.
  • Use a broad selection when you want a whole-subsystem summary.
  • Pair average force with Energy when you want to compare strong forces with the energetic profile.