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If the two important regions do not overlap, or overlap only partially, it is usually necessary to use the enhanced sampling techniques introduced in Sect. 1.4. This is schematically illustrated in Fig. 2.4d. One of these techniques, stratification, has [Pg.48]

2 Calculating Free Energy Differences Using Perturbation Theory [Pg.49]

See other pages where A Pictorial Representation of Free Energy Perturbation is mentioned: [Pg.48]