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e04545e26d80efficient_neuronet

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			compute fep examples
			====================

			* `CH4hyd` -- free energy of hydration of methane (very simple). FEP
			and TI methods.

			* `CH4-CF4` -- free energy difference of transforming methane into
			perfluoromethane, in water (simple). BAR method.

			* `CC-CO` -- free energy difference of transforming ethane into
			methanol, in water (more complex). FEP, TI and BAR methods.