A new multiscale approach for simulating nanobiological flows uses concurrent coupling of constrained molecular dynamics for long biomolecules with a mesoscopic lattice Boltzmann treatment of solvent hydrodynamics. The approach is based on a simple scheme of space-time information exchange between the atomistic and mesoscopic scales. © 2008 IEEE.
Multiscale simulation of nanobiological flows
Melchionna Simone;Succi Sauro
2008
Abstract
A new multiscale approach for simulating nanobiological flows uses concurrent coupling of constrained molecular dynamics for long biomolecules with a mesoscopic lattice Boltzmann treatment of solvent hydrodynamics. The approach is based on a simple scheme of space-time information exchange between the atomistic and mesoscopic scales. © 2008 IEEE.File in questo prodotto:
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