def get_chemical_formula(formula_string) needs to be moved elsewhere

madscatt / zazmol

Library for defining molecular objects to create simulation and analysis programs To install: python setup.py install dependencies: numpy, mocker

GNU General Public License v3.0

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Open madscatt opened 7 years ago

madscatt commented 7 years ago

Dangling method below class Atom in properties.

madscatt commented 7 years ago

was in sasutil ... perhaps it should stay there. (was commented out in sasutil .. has several local dependencies)

madscatt commented 7 years ago

moved to util.py, needs tests