File size: 816 Bytes
74e10df | 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 | SimulationType MonteCarlo
NumberOfCycles 10000
NumberOfInitializationCycles 2000
PrintEvery 100
Forcefield ExampleMoleculeForceField
Box 0
BoxLengths 30 30 30
ExternalTemperature 300.0
Movies yes
WriteMoviesEvery 10
Component 0 MoleculeName propane
MoleculeDefinition ExampleDefinitions
TranslationProbability 1.0
RotationProbability 1.0
ReinsertionProbability 1.0
CreateNumberOfMolecules 50
Component 1 MoleculeName butane
MoleculeDefinition ExampleDefinitions
TranslationProbability 1.0
RotationProbability 1.0
ReinsertionProbability 1.0
CreateNumberOfMolecules 50
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