Domain Center-based Cavity {{ index+1 }}
{% if is_cyclic %}
Warning: The center-based cavity is infinite.
{% endif %}
center: | {% for domain in domains: %}
({{ "%.4f, %.4f, %.4f"|format(domain[1][0], domain[1][1], domain[1][2]) }})
{% endfor %} |
surface: | {{ "%.4f"|format(surface) }} Å2 |
volume: | {{ "%.4f"|format(volume) }} Å3 |
volume fraction: | {{ "%.4f"|format(volume_fraction) }}% |
surface-area-to-volume ratio: | {{ "%.4f"|format(surface_to_volume_ratio) }} Å-1 |
center of mass: | ({{ "%.4f, %.4f, %.4f"|format(mass_center[0], mass_center[1], mass_center[2]) }}) |
squared gyration radius: | {{ "%.4f"|format(squared_gyration_radius) }} Å2 |
asphericity: | {{ "%.4f"|format(asphericity) }} |
acylindricity: | {{ "%.4f"|format(acylindricity) }} |
anisotropy: | {{ "%.4f"|format(anisotropy) }} |
characteristic radius: | {{ "%.4f"|format(characteristic_radius) }} Å |
Hide all other center cavities | |
Add to list of visible center cavities | |
Show all center cavities |
The following attributes are not available:
{% endif %}
-
{% for key in missing_values %}
- {{ key|replace('_', ' ') }} {% endfor %}
Attributes are missing since the dataset has been calculated with an older program version. Recalculate to gain a complete data set.