clearance attribution small fix
@@ -1852,7 +1852,7 @@ class SetupDatabase:
_OPENMM_LEAP_SOLVENT_FILES_MAP[solvent_model]))
logger.warning(solvent_warning)
leap_solvent_model = _OPENMM_LEAP_SOLVENT_MODELS_MAP[solvent_model]
- clearance = solvent['clearance'].value_in_unit(unit.angstroms)
+ clearance = solvent['clearance']
tleap.solvate(unit_name=unit_to_solvate, solvent_model=leap_solvent_model, clearance=clearance)
# First, determine how many ions we need to add for the ionic strength.
