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. Author manuscript; available in PMC: 2023 Jan 16.
Published in final edited form as: J Math Biol. 2019 Apr 27;79(2):631–672. doi: 10.1007/s00285-019-01372-1

Table 3.

Energy gain in 2nvh-w in kcal/mol

  ΔG for 2nvh   ΔG for 2nvh-w Energy gain
Super-Gaussian
ϵgap = 2 −2718.29 −2712.59   5.70
ϵgap = 3 −2571.37 −2568.22   3.15
ϵgap = 4 −2451.26 −2448.38   2.88
ϵgap = 5 −2347.51 −2345.69   1.82
ϵgap = 6 −2256.74 −2255.82   0.92
ϵgap = 7 −2176.10 −2175.96   0.14
ϵgap = 8 −2103.60 −2104.16 −0.56
2-dielectric −2960.40 −2957.34   3.06