unitsΒΆ
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-pdb2pqr/issues/485