SimulationType MonteCarlo NumberOfCycles 10000000000 NumberOfInitializationCycles 1000 PrintEvery 5000 Forcefield ExampleZeolitesForceField Framework 0 FrameworkName LTA_SI ShiftUnitCells 0.0 0.0 0.0 UnitCells 1 1 1 ExternalTemperature 600.0 ComputePositionHistogram yes WritePositionHistogramEvery 10000 component 0 MoleculeName methane MoleculeDefinition ExampleDefinitions BiasingProfile Profile.dat BiasingMethod Umbrella BiasingDirection A BlockPockets yes BlockPocketsFileName LTA_SI TranslationProbability 1.0 RotationProbability 1.0 ReinsertionProbability 1.0 CreateNumberOfMolecules 1 component 1 MoleculeName methane MoleculeDefinition ExampleDefinitions BlockPockets yes BlockPocketsFileName LTA_SI TranslationProbability 1.0 RotationProbability 1.0 ReinsertionProbability 1.0 CreateNumberOfMolecules 0