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Virtual, Local and Remote Laboratories for Conceptual Understanding of Dynamic Systems
(Tempus Publications, 2017-01-01)
Current cyberinfrastructure is changing the way scientists and engineers interact and work using digital technologies. In particular, online experimentation systems are revolutionizing how scientists and engineers collect ...
Numerical analysis of the dynamic frequency responses of damaged micro-lattice core sandwich plates
(Professional Engineering Publishing Ltd, 2020-01)
In this work, a numerical analysis of the dynamic frequency responses of sandwich plates with micro-lattice core is presented. The finite element analysis is implemented in the commercial software Abaqus/Standard, calculating ...
Self-organizing dynamical networks able to learn autonomously
(Europhysics Letters, 2018-09)
We present a model for the time evolution of network architectures based on dynamical systems. We show that the evolution of the existence of a connection in a network can be described as a stochastic non-Markovian telegraphic ...
QM–MM Ehrenfest dynamics from first principles: photodissociation of diazirine in aqueous solution
(Springer, 2018-09)
This article describes an implementation of Ehrenfest molecular dynamics based on TDDFT and Gaussian basis sets, optimized for hybrid QM–MM simulations in GPU. The present method makes use of the equations of motion proposed ...
Correction to "Conformational Dynamics of the Nicotinic Acetylcholine Receptor Channel: A 35-ns Molecular Dynamics Simulation Study"
(American Chemical Society, 2015-03)
The nicotinic acetylcholine receptor (AChR) is the paradigm of ligand-gated ion channels, integral membrane proteins that mediate fast intercellular communication in response to neurotransmitters. A 35-ns molecular dynamics ...
Simultaneous Orientational and Conformational Molecular Dynamics in Solid 1,1,2-Trichloroethane
(American Chemical Society, 2018-03-22)
The molecular dynamics in the ambient-pressure solid phase of 1,1,2-trichloroethane is studied by means of broadband dielectric spectroscopy and molecular dynamics simulations. The dielectric spectra of polycrystalline ...
Exploring the Picosecond Time Domain of the Solvation Dynamics of Coumarin 153 within β-Cyclodextrins
(American Chemical Society, 2008-07)
We report molecular dynamics simulation results of equilibrium and dynamical characteristics pertaining to the solvation of the dye coumarine 153 (C153) trapped within hydrophobic cavities of di- and trimethylated ...
Allee effect in models of interacting species
(Pergamon-Elsevier Science Ltd, 2021-12)
The search for more realistic models for interacting species has produced many adaptations of the original Lotka-Volterra equations, such as the inclusion of the Allee effect and the different Holling's types of functional ...
Local seismic response of the Las Dos Bocas dam, tothrough a nonlinear analysisRespuesta sísmica local de la presa Las Dos Bocas utilizando un análisis no lineal
(Instituto Tecnológico de Santo Domingo (INTEC), 2019)