-15
U-U
b 2
*
-10
pentamer
tetramer
trimer
dimer
-5
N-N
0
Ci
HS B B − b2* ≡ 22 HS 22 B22
i
ε+/- or εhp
ε+/-
TM
U D
⎛ ∆Gi0 ⎞ = exp ⎜ − ⎟ ⎝ k BT ⎠
λ σ0
σ0
( Cmon )
W2
Ki ≡
weakly hydrophobic
Young and Roberts, J. Chem. Phys. (2007, in press)
-20
-15
-12
-9
-6
-3
0
strongly hydrophobic
Cell-based theory provides accurate statistical thermodynamics of dilute solutions & basis for multi-scale simulations of dense fluids. Example below is for the free energy of cluster formation in colloid or protein solutions (φ < ca. 2%)