By weighting the individual averaged energy contributions (separately for folding free energies and protein-protein binding affinities) water contributions are implicitly taken into account.

Uniform Energy Factor refers to a water heater's efficiency when run under simulated heavy use conditions for a 24-hour period. Electric Heat Pump is part of the Water Heaters test program at ...

FEP calculations have had a revolutionary effect on computational chemistry. In conjunction with molecular dynamics and Monte Carlo simulations, they have enabled the calculation of free energy ...