DYNAMISM (Dynamic Modeling and Analysis for Model-Free Dynamics)A software package for the description, analysis and prediction of dynamics of molecules with internally diffusing axes.For more details see the web pages at: http://www.dynism.de Features: Supports single- or double-exponential or mono-exponential relaxation model. Supports relaxing molecules with internal motion (structure and/or motion of bonds, rotational and translational motion), assuming an isotropic internal motion. Supports for single or multiple relaxation modes. Single-exponential model includes diffusion of the relaxation modes (and correlation times). Double-exponential model allows for non-exponential effects. Supports prolate hyperfine coupling. supports sampling of the molecular tumbling angle. allows to place the internal motion axis of the molecule anywhere in 3D, as well as to determine the amplitude of the internal motion based on atomic displacement parameters. allows to calculate a time-varying internal motion based on the relaxation timescale.
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