M/MM and All-Atom/Coarse-Grained Molecular Dynamics are two of the most ommon multiscale approaches in computational chemistry. Describe the flow of formation between the two single-scale models in each of the two methods (use iagrams if appropriate). Explain, with reference to these multiscale models, what is heant by hierarchical and concurrent coupling and give an example of where each pproach is most appropriate.
M/MM and All-Atom/Coarse-Grained Molecular Dynamics are two of the most ommon multiscale approaches in computational chemistry. Describe the flow of formation between the two single-scale models in each of the two methods (use iagrams if appropriate). Explain, with reference to these multiscale models, what is heant by hierarchical and concurrent coupling and give an example of where each pproach is most appropriate.
Chapter12: Relativity, Particle Physics, And Cosmology
Section: Chapter Questions
Problem 28Q
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