mstk.chem.element.Element

class mstk.chem.element.Element(arg)

Methods

__init__(arg)
guess_from_atom_type(type)	Guess the element from the first two characters of atom type Will only guess TEAM and CL&P atom types TEAM atom types are lowercase CL&P atom types are title case

static guess_from_atom_type(type)

Guess the element from the first two characters of atom type Will only guess TEAM and CL&P atom types TEAM atom types are lowercase CL&P atom types are title case