Table 13.
Potentials of mean force Fi (in kBT), diffusion constants Di (10−5 cm2/s), and slab widths for compartmental models for O2 sketched in Fig. 31, and permeabilities P (cm/s) from Eq. (43).
Model | F1 | F2 | F3 | D1 | D2 | D3 | h1 | h2 | h3 | P |
---|---|---|---|---|---|---|---|---|---|---|
M1. water/hexadecane | −3.0 | −3.3 | 0 | 4.6 | 4.6 | 6.0 | 20 | 5 | 10 | 276 |
M2. barrier at interface | −3.0 | 1.0 | 0 | 4.6 | 4.6 | 6.0 | 20 | 5 | 10 | 106 |
M3. increase thickness | −3.0 | −3.0 | 1.0 | 4.6 | 4.6 | 6.0 | 5 | 12.5 | 10 | 107 |
M4. reduce D at interface | −3.0 | −3.0 | 1.0 | 4.6 | 4.6 | 1.5 | 5 | 12.5 | 10 | 27 |
M5. POPC model | −3.0 | −2.0 | 1.0 | 1.5 | 3.0 | 1.5 | 5 | 12.5 | 10 | 25 |