sdie¶
Note
Some versions of this command have been ported to the new APBS syntax (see YAML- and JSON-format input files):
- Finite difference Poisson-Boltzmann calculations: see
FiniteDifference.solvent_dielectric()
for more information.
Todo
port for other calculation types
Specify the dielectric constant of the solvent. The syntax is:
sdie {diel}
where diel
is a floating point number representing the solvent dielectric constant (unitless).
This number must be \(\ge 1\).
Bulk water at biologically-relevant temperatures is usually modeled with a dielectric constant of 78-80.