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Component spectroscopic properties of light-harvesting complexes with DFT calculations
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作者 SHYAM BADU SANJAY PRABHAKAR RODERICK MELNIK 《BIOCELL》 SCIE 2020年第3期279-291,共13页
Photosynthesis is a fundamental process in biosciences and biotechnology that influences profoundly the research in other disciplines.In this paper,we focus on the characterization of fundamental components,present in... Photosynthesis is a fundamental process in biosciences and biotechnology that influences profoundly the research in other disciplines.In this paper,we focus on the characterization of fundamental components,present in pigment-protein complexes,in terms of their spectroscopic properties such as infrared spectra,nuclear magnetic resonance,as well as nuclear quadrupole resonance,which are of critical importance for many applications.Such components include chlorophylls and bacteriochlorophylls.Based on the density functional theory method,we calculate the main spectroscopic characteristics of these components for the Fenna-Matthews-Olson light-harvesting complex,analyze them and compare them with available experimental results.Future outlook is discussed in the context of current and potential applications of the presented results. 展开更多
关键词 PHOTOSYNTHESIS BACTERIOCHLOROPHYLLS Light HARVESTING Pigment-protein complexes Density functional theory Complex networks Photocatalysis BIOSENSING and bioplasmonics
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Complex non-Markovian dynamics and the dual role of astrocytes in Alzheimer's disease development and propagation
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作者 Swadesh Pal Roderick Melnik 《Quantitative Biology》 2025年第3期77-90,共14页
Alzheimer’s disease(AD)is a common neurodegenerative disorder nowadays.Amyloid-beta(Aβ)and tau proteins are among the main contributors to the AD progression.In AD,Aβproteins clump together to form plaques and disr... Alzheimer’s disease(AD)is a common neurodegenerative disorder nowadays.Amyloid-beta(Aβ)and tau proteins are among the main contributors to the AD progression.In AD,Aβproteins clump together to form plaques and disrupt cell functions.On the other hand,the abnormal chemical change in the brain helps to build sticky tau tangles that block the neuron’s transport system.Astrocytes generally maintain a healthy balance in the brain by clearing the Aβplaques(toxic Aβ).However,overactivated astrocytes release chemokines and cytokines in the presence of Aβand react to pro-inflammatory cytokines,further increasing the production of Aβ.In this study,we construct a mathematical model that can capture astrocytes’dual behavior.Furthermore,we reveal that the disease progression depends on the current time instance and the disease’s earlier status,called theamemory effect,omaking non-Markovian processes an appropriate approach.We consider a fractional order network mathematical model to capture the influence of such memory effects on AD progression.We have integrated brain connectome data into the model and studied the memory effect,the dual role of astrocytes,and the brain’s neuronal damage.Based on the pathology,primary,secondary,and mixed tauopathies parameters are considered in the model.Due to the mixed tauopathy,different brain nodes or regions in the brain connectome accumulate different toxic concentrations of Aβand tau proteins.Finally,we explain how the memory effect can slow down the propagation of such toxic proteins in the brain,decreasing the rate of neuronal damage. 展开更多
关键词 Alzheimer’s disease and neurodegeneration ASTROCYTES brain connectome Caputo fractional derivatives data-driven modeling network models non-Markovian processes
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ASYMPTOTIC LIMITS AND STABILIZATION FOR THE 1D NONLINEAR MINDLIN-TIMOSHENKO SYSTEM 被引量:2
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作者 F.D.ARARUNA P.BRAZ E SILVA E.ZUAZUA 《Journal of Systems Science & Complexity》 SCIE EI CSCD 2010年第3期414-430,共17页
This paper shows how the so called von Karman model can be obtained as a singular limit of a modified Mindlin-Timoshenko system when the modulus of elasticity in shear κ tends to infinity, provided a regularizing ter... This paper shows how the so called von Karman model can be obtained as a singular limit of a modified Mindlin-Timoshenko system when the modulus of elasticity in shear κ tends to infinity, provided a regularizing term through a fourth order dispersive operator is added. Introducing damping mechanisms, the authors also show that the energy of solutions for this modified Mindlin-Timoshenko system decays exponentially, uniformly with respect to the parameter k. As κ→∞, the authors obtain the damped von Karman model with associated energy exponentially decaying to zero as well. 展开更多
关键词 Mindlin-Timoshenko system singular limit uniform stabilization vibrating beams von Karman system.
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Scalable and automated CRISPR-based strain engineering using droplet microfluidics 被引量:3
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作者 Kosuke Iwai Maren Wehrs +11 位作者 Megan Garber Jess Sustarich Lauren Washburn Zachary Costello Peter W.Kim David Ando William R.Gaillard Nathan J.Hillson Paul D.Adams Aindrila Mukhopadhyay Hector Garcia Martin Anup K.Singh 《Microsystems & Nanoengineering》 SCIE EI CSCD 2022年第2期227-236,共10页
We present a droplet-based microfluidic system that enables CRISPR-based gene editing and high-throughput screening on a chip.The microfluidic device contains a 10x10 element array,and each element contains sets of el... We present a droplet-based microfluidic system that enables CRISPR-based gene editing and high-throughput screening on a chip.The microfluidic device contains a 10x10 element array,and each element contains sets of electrodes for two electric field-actuated operations:electrowetting for merging droplets to mix reagents and electroporation for transformation.This device can perform up to 100 genetic modification reactions in parallel,providing a scalable platform for generating the large number of engineered strains required for the combinatorial optimization of genetic pathways and predictable bioengineering.We demonstrate the system's capabilities through the CRISPR-based engineering of two test cases:(1)disruption of the function of the enzyme galactokinase(galK)in£coli and(2)targeted engineering of the glutamine synthetase gene(glnA)and the blue-pigment synthetase gene(bpsA)to improve indigoidine production in£coli. 展开更多
关键词 operations GENERATING FLUID
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ParametricVibration Analysis of Pipes Conveying Fluid by Nonlinear Normal Modes and a Numerical Iterative Approach 被引量:1
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作者 Feng Liang Xiaodong Yang +2 位作者 Wei Zhang Yingjing Qian Roderick V.N.Melnik 《Advances in Applied Mathematics and Mechanics》 SCIE 2019年第1期38-52,共15页
Nonlinear normal modes and a numerical iterative approach are applied to study the parametric vibrations of pipes conveying pulsating fluid as an example of gyroscopic continua.The nonlinear non-autonomous governing e... Nonlinear normal modes and a numerical iterative approach are applied to study the parametric vibrations of pipes conveying pulsating fluid as an example of gyroscopic continua.The nonlinear non-autonomous governing equations are transformed into a set of pseudo-autonomous ones by employing the harmonic balance method.The nonlinear normal modes are constructed by the invariant manifold method on the state space and a numerical iterative approach is adopted to obtain numerical solutions,in which two types of initial conditions for the modal coefficients are employed.The results show that both initial conditions can lead to fast convergence.The frequency-amplitude responses with some modal motions in phase space are obtained by the present iterative method.Quadrature phase difference and traveling waves are found in the time-domain complex modal analysis. 展开更多
关键词 Gyroscopic continua pipes conveying pulsating fluid parametric vibration nonlinear normal modes iterative approach
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Vector-valued operators, optimal weighted estimates and the C_p condition
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作者 María Eugenia Cejas Kangwei Li +1 位作者 Carlos Pérez Israel Pablo Rivera-Ríos 《Science China Mathematics》 SCIE CSCD 2020年第7期1339-1368,共30页
In this paper some new results concerning the C_p classes introduced by Muckenhoupt(1981)and later extended by Sawyer(1983),are provided.In particular,we extend the result to the full expected range p>0,to the weak... In this paper some new results concerning the C_p classes introduced by Muckenhoupt(1981)and later extended by Sawyer(1983),are provided.In particular,we extend the result to the full expected range p>0,to the weak norm,to other operators and to their vector-valued extensions.Some of those results rely upon sparse domination,which in the vector-valued case are provided as well.We will also provide sharp weighted estimates for vector-valued extensions relying on those sparse domination results. 展开更多
关键词 A_p weights quantitative estimates C_p estimates vector-valued extensions sparse domination maximal functions Calderon-Zygmund operators COMMUTATORS
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A Modified Discontinuous GalerkinMethod for Solving Efficiently Helmholtz Problems
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作者 Magdalena Grigoroscuta-Strugaru Mohamed Amara +1 位作者 Henri Calandra Rabia Djellouli 《Communications in Computational Physics》 SCIE 2012年第2期335-350,共16页
A new solution methodology is proposed for solving efficiently Helmholtz problems.The proposed method falls in the category of the discontinuous Galerkin methods.However,unlike the existing solution methodologies,this... A new solution methodology is proposed for solving efficiently Helmholtz problems.The proposed method falls in the category of the discontinuous Galerkin methods.However,unlike the existing solution methodologies,this method requires solving(a)well-posed local problems to determine the primal variable,and(b)a global positive semi-definite Hermitian system to evaluate the Lagrange multiplier needed to restore the continuity across the element edges.Illustrative numerical results obtained for two-dimensional interior Helmholtz problems are presented to assess the accuracy and the stability of the proposed solution methodology. 展开更多
关键词 Helmholtz equation discontinuous Galerkin plane waves Lagrange multipliers inf-sup condition waveguide problems
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