diff --git a/devtools/data/gen-serialized-results.py b/devtools/data/gen-serialized-results.py index ca7ff220..74a00c8f 100644 --- a/devtools/data/gen-serialized-results.py +++ b/devtools/data/gen-serialized-results.py @@ -82,9 +82,9 @@ def generate_md_json(smc): def generate_ahfe_json(smc): settings = AbsoluteSolvationProtocol.default_settings() settings.solvent_simulation_settings.equilibration_length = 10 * unit.picosecond - settings.solvent_simulation_settings.production_length = 500 * unit.picosecond + settings.solvent_simulation_settings.production_length = 10 * unit.picosecond settings.vacuum_simulation_settings.equilibration_length = 10 * unit.picosecond - settings.vacuum_simulation_settings.production_length = 1000 * unit.picosecond + settings.vacuum_simulation_settings.production_length = 10 * unit.picosecond settings.lambda_settings.lambda_elec = [0.0, 0.25, 0.5, 0.75, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0, 1.0]