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The objective of the present study is to review the mechanisms and computational models used to assess the risk that a drug may TdP.
Recent work, for example, has found that CNNs can be used to predict the behavior of humans and non-human primates, large-scale activation of brain regions, and even the firing patterns of individual neurons — leading to speculation that the mechanisms and computational principles underlying CNNs may resemble those of our own brains4,5,6,7,8,9,10,11.
Many techniques have been used to delineate reaction mechanisms, and computational approaches are particularly useful.
The precise mechanisms and computational processes, however, which may be implicated in translating novelty into reward responses, are unclear.
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In this regards, an improved reaction mechanism and computational model, validated experimentally, for oxidative coupling of methane (OCM) over a Mn/Na2WO4/SiO2 catalyst is developed, taking into account the non-isothermal behavior exhibited by the gas and surface reactions.
Based on the assumed catalytic mechanism and computational docking of Aza to the active site of the enzyme, active-site residues were selected for construction of focused mutant libraries, which were thereafter screened for Aza activity.
Therefore, it would be critical to decipher their molecular mechanisms by experimental and computational approaches for establishing therapeutic strategies.
The goal is to calibrate automatically the multi-component kinetic mechanism, which also leads to a chemically consistent PRF mechanism and a computational advantage for the calibration process.
There may be other kinase-substrate pairs in which the stoichiometry is not limiting for the substrate-selective mechanism and our computational model is easily adapted for their evaluation.
Neuroeconomics is interested in understanding the interrelationship between computational mechanisms that exist in our evolved brains and computational mechanisms that exist in our constructed institutions.
The theoretical development is composed of full-mode-participation method, some new findings in flutter mechanism and stabilization and computational fluid dynamics (CFD) techniques and application, and some probabilistic assessment approaches are proposed and applied in wind-induced vibration including flutter instability, buffeting response and vortex-induced vibration.
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