Table 2.

Decomposition of the compute binding free energies from Table 1 into average binding energies, 〈u〉₁ and reorganization free energy, $\mathrm{\Delta }{G}_{\mathit{reorg}}^{\circ }$, components.

	$\mathrm{\Delta }{G}_b^{\circ }(\text{BEDAM})$ a	〈u〉1a	$\mathrm{\Delta }{G}_{\mathit{reorg}}^{\circ }$ a
guest1	−7.6	−26.8	19.2
guest2	−7.3	−37.9	30.6
guest3	−5.8	−24.2	18.4
guest4	−3.9	−22.2	18.3
guest5	−6.1	−25.3	19.2
guest6	−8.9	−45.0	36.1
guest7	−8.7	−38.1	29.4

^aIn kcal/mol.