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Molecular dynamics simulation can reveal conformational dynamics of host-guest complexes, but simulating larger systems can be challenging. Here a modular approach allows simulation of a neocarcerand whose complexation is enabled by the guest-induced ...
Katherine G. McFerrin, Yuan-Ping Pang
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Tuberculosis (TB) is one of the leading causes of death worldwide. The development of new anti-tubercular drugs is required as resistant strains of M. tuberculosis to various first-line drugs are currently available.
Jakaria Shawon +3 more
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Advancements in energy technologies created a new application for gas turbine generators, which are used to balance load. This usage also brought new challenges for maintenance because of harsh operating conditions that make turbines more susceptible to ...
Konstantin Zadiran, Maxim Shcherbakov
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Solving the problem of optimal design for a two-stage reducer by using a modified evolutionary algorithm [PDF]
The work is devoted to solving the problem of selecting optimal geometric parameters of gears of a two-stage cylindrical reducer using a modified evolutionary algorithm (EA).
Ustynenko Oleksandr +2 more
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The use of a directional overcurrent protection relay (DOPR) to protect an electrical power system is a crucial instrument for keeping the system dynamic and avoiding undue interruption.
Kashif Habib +5 more
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Computer-aided verification in mechanism design [PDF]
In mechanism design, the gold standard solution concepts are dominant strategy incentive compatibility and Bayesian incentive compatibility. These solution concepts relieve the (possibly unsophisticated) bidders from the need to engage in complicated ...
AV Goldberg +9 more
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Ampakine compounds have been shown to reverse opiate-induced respiratory depression by activation of amino-3-hydroxy-5-methyl-4-isoxazolepropionic acid (AMPA) glutamate receptors.
Dian Xiao +6 more
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Reducing the Concepts of Data Science and Machine Learning to Tools for the Bench Chemist
Machine Learning and Data Science have enjoyed a renaissance due to the availability of increased computational power and larger data sets. Many questions can be now asked and answered, that previously were beyond our scope.
Richard A. Lewis +3 more
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Calculation of fatigue fracture in structural elements using a multimode damage model [PDF]
The problem of nucleation and development for the fatigue fracture process in element of aircraft structure is solved using previously developed cyclic damage model.
Nikitin Ilia +2 more
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In recent years, human motion prediction has become an active research topic in computer vision. However, owing to the complexity and stochastic nature of human motion, it remains a challenging problem.
Lujing Chen +5 more
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