units

Todo

This command has not yet been ported to the new APBS syntax (see YAML- and JSON-format input files).

Specify the units for energy/force/potential output in PB-(S)AM calculations:

units {flag}

where flag specifies the unit system:

kcalmol

kcal/mol

jmol

J/mol

kT

kT

Force units will be energy units/Angstrom and potential units will be energy units/electron.

Todo

It would be great to use the same units everywhere in APBS. Documented in https://github.com/Electrostatics/apbs/issues/485