biotite.structure.filter_solvent

biotite.structure.filter_solvent(array)

Filter all atoms of one array that are part of the solvent.

Parameters

arrayAtomArray or AtomArrayStack

The array to be filtered.

Returns

filterndarray, dtype=bool

This array is True for all indices in array, where the atom belongs to the solvent.

Gallery

Superimposition of two protein structures

Superimposition of two protein structures

Solvation shells of sodium and chloride ions

Solvation shells of sodium and chloride ions