xnn.ffnn.models.oplslib.resolve_angle_type#

xnn.ffnn.models.oplslib.resolve_angle_type(angle_types, a, b, c)[source]#

Find the angle-type key for the class triple (a, b, c).

Parameters:
  • angle_types (dict) – The library’s angle-type table.

  • a (str) – Atom classes, center second.

  • b (str) – Atom classes, center second.

  • c (str) – Atom classes, center second.

Returns:

The matching key (forward or reversed), or None.

Return type:

str or None