diff --git a/examples/USER/fep/README b/examples/USER/fep/README index 187c26be80..64c46f2b03 100644 --- a/examples/USER/fep/README +++ b/examples/USER/fep/README @@ -9,3 +9,6 @@ compute fep examples * `CC-CO` -- free energy difference of transforming ethane into methanol, in water (more complex). FEP, TI and BAR methods. + +* 'C7inEthanol' -- insertion / deletion of a hexane molecule in ethanol. + The hexane is described by the lj/class2/coul/long/soft potential.