OESolventModel¶
This namespace contains constants describing solvation model of a molecule in solution
NoSolv
No solvation. Gas-phase molecule.
Sheffield
Simplified analytical electrostatic solvation model used.
PB
Poisson–Boltzmann electrostatic solvation model used.
Cavity
Surface Area hydrophobic solvation model used. It might be used in combination with electrostatic PB or Sheffield solvation models.