Uses of Class
org.openmolecules.chem.conf.gen.RotatableBond
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Packages that use RotatableBond Package Description org.openmolecules.chem.conf.gen -
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Uses of RotatableBond in org.openmolecules.chem.conf.gen
Fields in org.openmolecules.chem.conf.gen declared as RotatableBond Modifier and Type Field Description protected RotatableBond[]
TorsionSetStrategy. mRotatableBond
Constructors in org.openmolecules.chem.conf.gen with parameters of type RotatableBond Constructor Description TorsionSetStrategy(RotatableBond[] rotatableBond, RigidFragment[] fragment)
TorsionSetStrategyAdaptiveRandom(RotatableBond[] rotatableBond, RigidFragment[] fragment, boolean preferLikelyTorsions, boolean startWithMostProbable, long seed)
This torsion set strategy produces random sets of torsion indices until a torsion set collides.TorsionSetStrategyLikelySystematic(RotatableBond[] rotatableBond, RigidFragment[] fragment)
TorsionSetStrategyRandom(RotatableBond[] rotatableBond, RigidFragment[] fragment, boolean preferLikelyTorsions, long seed)
This simple TorsionSetStrategy produces random sets of torsion indexes in a loop.
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