نتایج جستجو برای: efp

تعداد نتایج: 314  

2006
H. B. Danesh Gavriel Salomon

This paper proposes the integrative theory of peace (ITP) and briefly outlines the education for peace curriculum (EFP) developed on the basis of this theory. ITP is based on the concept that peace is, at once, a psychological, social, political, ethical and spiritual state with its expressions in intrapersonal, interpersonal, intergroup, international, and global areas of human life. The theor...

Journal: :Journal of computational chemistry 2007
Lyudmila V. Slipchenko Mark S. Gordon

Evaluation of the electrostatic energy within the effective fragment potential (EFP) method is presented. The performance of two variants of the distributed multipole analysis (DMA) together with two different models for estimating the charge penetration energies was studied using six homonuclear dimers. The importance of damping the higher order multipole terms, i.e. charge dipole, was also in...

Journal: :International Journal of Impact Engineering 2016

2016
Emilie B. Guidez Peng Xu Mark S. Gordon Emilie B Guidez

The dispersion interaction energy may be expressed as a sum over R−n terms, with n ≥ 6. Most implementations of the dispersion interaction in model potentials are terminated at n = 6. Those implementations that do include higher order contributions commonly only include even power terms, despite the fact that odd power terms can be important. Because the effective fragment potential (EFP) metho...

Journal: :The journal of physical chemistry. A 2011
Debashree Ghosh Olexandr Isayev Lyudmila V Slipchenko Anna I Krylov

The effect of hydration on the vertical ionization energy (VIE) of thymine was characterized using equation-of-motion ionization potential coupled-cluster (EOM-IP-CCSD) and effective fragment potential (EFP) methods. We considered several microsolvated clusters as well as thymine solvated in bulk water. The VIE in bulk water was computed by averaging over solvent-solute configurations obtained ...

2017
Nayeli Huidobro Abraham Mendez-Fernandez Ignacio Mendez-Balbuena Ranier Gutierrez Rumyana Kristeva Elias Manjarrez

Stochastic resonance (SR) is an inherent and counter-intuitive mechanism of signal-to-noise ratio (SNR) facilitation in biological systems associated with the application of an intermediate level of noise. As a first step to investigate in detail this phenomenon in the somatosensory system, here we examined whether the direct application of noisy light on pyramidal neurons from the mouse-barrel...

Journal: :Infection and immunity 2014
Hannah E Marman Alexandra R Mey Shelley M Payne

Elongation factor P (EF-P) is a universally conserved bacterial translation factor. In many bacteria, EF-P is posttranslationally modified by PoxA, which covalently attaches a β-lysine to a conserved lysine residue of EF-P. Here we show that both EF-P and PoxA are necessary for virulence of the human diarrheal pathogen Shigella flexneri. Loss of either EF-P or PoxA leads to an impaired ability ...

Journal: :The journal of physical chemistry. A 2016
Emilie B Guidez Peng Xu Mark S Gordon

The dispersion interaction energy may be expressed as a sum over R(-n) terms, with n ≥ 6. Most implementations of the dispersion interaction in model potentials are terminated at n = 6. Those implementations that do include higher order contributions commonly only include even power terms, despite the fact that odd power terms can be important. Because the effective fragment potential (EFP) met...

Journal: :Journal of applied biomechanics 2014
A Greenhalgh P J Taylor J Sinclair

The examination of synchronous three dimensional (3-D) kinetics and kinematics of walking in laboratory based analyses typically requires participants/patients to make foot contact with a force or pressure measuring device. However, it has been proposed that this may lead to targeting whereby participants modify their natural gait pattern in order to ensure contact with the device. This study a...

Journal: :Journal of visualized experiments : JoVE 2017
Kai Wang Xi Wang Cheng-Sheng Han Liang-Yi Chen Ying Luo

Islet transplantation has been clinically proven to be effective at treating type 1 diabetes. However, the current intrahepatic transplantation strategy may incur acute whole blood reactions and result in poor islet engraftment. Here, we report a robust protocol for the transplantation of islets at the extrahepatic transplantation site-the epididymal fat pad (EFP)-in a diabetic mouse model. A p...

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