Package nMOLDYN :: Package Analysis :: Module Dynamics |
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# Module Dynamics

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    Collections of classes for the determination of dynamics-related properties.

    Classes:

        * MeanSquareDisplacement                   : sets up a Mean-Square-Displacement analysis.
        * RootMeanSquareDeviation                  : sets up a Root Mean-Square-Deviation analysis.
        * GyrationRadius                           : sets up a Gyration Radius analysis.
        * AngularCorrelation                       : sets up an Angular Correlation analysis.
        * CartesianVelocityAutoCorrelationFunction : sets up a Cartesian Velocity AutoCorrelation analysis.
        * DensityOfStates                          : sets up a Density Of States analysis.
        * AutoRegressiveAnalysis                   : sets up an Auto-Regressive analysis.
        * QuasiHarmonicAnalysis                    : sets up a Quasi-Harmonic analysis.
        * PassBandTrajectoryFilter                 : sets up a Pass-Band Trajectory Filter.
        * GlobalMotionTrajectoryFilter             : sets up a Global Motion Trajectory Filter.
        * CenterOfMassTrajectory                   : sets up a Center Of Mass Trajectory.
        * RigidBodyTrajectory                      : sets up a Rigid-Body Trajectory.
        * AngularVelocityAutoCorrelationFunction   : sets up an Angular Velocity AutoCorrelation Function.
        * AngularDensityOfStates                   : sets up an Angular Density Of States.

Classes | [hide private]
| MeanSquareDisplacement Sets up a Mean Square Displacement analysis.
| RootMeanSquareDeviation Sets up a Root Mean Square Deviation analysis.
| CartesianVelocityAutoCorrelationFunction Sets up a Cartesian Velocity AutoCorrelation analysis.
| CartesianDensityOfStates Sets up a Cartesian Density Of States analysis.
| AutoRegressiveAnalysis Sets up an AutoRegressive Analysis analysis.
| PassBandFilteredTrajectory Sets up a Pass-Band Trajectory Filter analysis.
| RadiusOfGyration Sets up a Radius Of Gyration analysis.
| GlobalMotionFilteredTrajectory Sets up a Global Motion Trajectory Filter analysis.
| CenterOfMassTrajectory Sets up a Center Of Mass Trajectory analysis.
| QuasiHarmonicAnalysis Sets up a Quasi Harmonic Analysis analysis.
| AngularCorrelation Sets up an Angular Correlation analysis.
| RigidBodyTrajectory Sets up a Rigid Body Trajectory analysis.
| ReorientationalCorrelationFunction Sets up a Reorientational Correlation Function analysis.
| AngularVelocity An intermediate class used by |AngularVelocityAutoCorrelationFunction| and |AngularDensityOfStates| classes.
| AngularVelocityAutoCorrelationFunction Sets up an Angular Velocity AutoCorrelation Function analysis.
| AngularDensityOfStates Sets up an Angular Density Of States analysis.