espaloma.mm.geometry

Functions

angle(x0, x1, x2)	Angle between three points.
apply_angle(nodes)	Angle values in nodes.
apply_bond(nodes)	Bond length in nodes.
apply_torsion(nodes)	Torsion dihedrals in nodes.
copy_src(src, out)	Copy source of an edge.
dihedral(x0, x1, x2, x3)	Dihedral between four points.
distance(x0, x1)	Distance.
geometry_in_graph(g)	Assign values to geometric entities in graphs.
reduce_stack(msg, out)	Copy massage and stack.

Classes

GeometryInGraph(*args, **kwargs)