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First-principle path integral study of DNA under hydrodynamic flows
First-principle path integral DNA hydrodynamic flows
2014/9/24
We use the worm-like chain as a first-principles model to study single molecule experiments of double stranded DNA subject to constant plug, elongational, and shear flows. The steady-state configurati...
Adiabatic path integral molecular dynamics methods. II. Algorithms
Adiabatic path integral molecular dynamics methods Algorithms
2014/9/24
Efficient numerical algorithms are developed for use with two finite temperature semiclassical approximations to quantum dynamics both of which require trajectories generated on potentials of mean for...