Significados de dynamic simulation em inglês

The initial decomposition pathways were also proposed on the basis of molecular dynamic simulation.

The best compound Dihydroquercetin was compared with Donepezil drug through molecular dynamic simulation studies.

And you can see that he's having to complete a task while going through this really dynamic simulation.

A force-balance-based dynamic simulation of the filament networks has multiple advantages as an approach to understanding their anomalous mechanics.

The global switching trajectory surface hopping method is demonstrated to be well suited to TDDFT on-the-fly dynamic simulation with and without spin-flip.

Conclusion: These findings highlight the value of a participatory approach to dynamic simulation modelling to support its utility in applied health policy settings.

The stability of this structure was checked in 39 ps molecular dynamic simulation at 330 K in water.

We employ the on-the-fly surface hopping algorithm with an ab initio quantum chemistry calculation to demonstrate a dynamic simulation for photoisomerization in azobenzene.

Molecular dynamic simulation using X-ray crystal structure of AChE from Torpedo californica was used to explain the possible binding mode of these new compounds.

Based on computational fluid dynamic simulations the principle of the set-up is discussed.

This can be qualitatively understood by comparing with molecular dynamic simulations of Lennard-Jones fluids.

Free energy calculation through molecular dynamic simulations revealed a role for T234 in regulating podocin dimerization.

Molecular dynamic simulations suggested that water molecules permeate freely through the central and side channel pores.

Dynamic simulations of movement allow one to study neuromuscular coordination, analyze athletic performance, and estimate internal loading of the musculoskeletal system.

Here, using molecular dynamic simulations and docking, we studied the binding of known inhibitors to representative members of classical and nonclassical calpains.

State-of-the-art molecular dynamic simulations confirm the experimental findings, which result in sensibly decreased DNA interaction free energy than normally predicted by Poisson-Boltzmann methods.