scholarly journals Specific and Non-Specific Protein Association in Solution: Computation of Solvent Effects and Prediction of First-Encounter Modes for Efficient Configurational Bias Monte Carlo Simulations

2013 ◽  
Vol 117 (41) ◽  
pp. 12360-12374 ◽  
Author(s):  
Antonio Cardone ◽  
Harish Pant ◽  
Sergio A. Hassan
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Solvent Effects ◽  
Specific Protein ◽  
Protein Association

Solvent Effects on the Barrier to C−N Bond Rotation inN,N-Dimethylaminoacrylonitrile:  Modeling by Reaction Field Theory and by Monte Carlo Simulations

1999 ◽  
Vol 121 (1) ◽  
pp. 227-237 ◽  
Author(s):  
Paul R. Rablen ◽  
Shoshannah A. Pearlman ◽  
Deborah A. Miller
Keyword(s):  
Field Theory ◽  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Solvent Effects ◽  
Reaction Field ◽  
Bond Rotation

Solvent effects on molecular spectra. I. Normal pressure and temperature Monte Carlo simulations of the structure of dilute pyrimidine in water

1993 ◽  
Vol 99 (3) ◽  
pp. 1482-1495 ◽  
Author(s):  
J. Zeng ◽  
J. S. Craw ◽  
N. S. Hush ◽  
J. R. Reimers
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Solvent Effects ◽  
Normal Pressure ◽  
Molecular Spectra

Low-voltage EDS of magnesium ferrite Dendrites in a FEG-SEM

1996 ◽  
Vol 54 ◽  
pp. 478-479
Author(s):  
Matthew T. Johnson ◽  
Ian M. Anderson ◽  
Jim Bentley ◽  
C. Barry Carter
Keyword(s):  
Monte Carlo ◽  
Quantitative Analysis ◽  
Monte Carlo Simulations ◽  
Cross Section ◽  
Spatial Resolution ◽  
Low Voltage ◽  
Magnesium Ferrite ◽  
X Ray ◽  
Interaction Volume ◽  
Ferrite Spinel

Energy-dispersive X-ray spectrometry (EDS) performed at low (≤ 5 kV) accelerating voltages in the SEM has the potential for providing quantitative microanalytical information with a spatial resolution of ∼100 nm. In the present work, EDS analyses were performed on magnesium ferrite spinel [(MgxFe1−x)Fe2O4] dendrites embedded in a MgO matrix, as shown in Fig. 1. spatial resolution of X-ray microanalysis at conventional accelerating voltages is insufficient for the quantitative analysis of these dendrites, which have widths of the order of a few hundred nanometers, without deconvolution of contributions from the MgO matrix. However, Monte Carlo simulations indicate that the interaction volume for MgFe2O4 is ∼150 nm at 3 kV accelerating voltage and therefore sufficient to analyze the dendrites without matrix contributions.Single-crystal {001}-oriented MgO was reacted with hematite (Fe2O3) powder for 6 h at 1450°C in air and furnace cooled. The specimen was then cleaved to expose a clean cross-section suitable for microanalysis.

High frequency analysis of fast devices using small-signal Monte Carlo simulations : application to a 0.1 μm-gate MODFET

1993 ◽  
Vol 3 (9) ◽  
pp. 1713-1718 ◽  
Author(s):  
P. Dollfus ◽  
S. Galdin ◽  
C. Brisset ◽  
P. Hesto
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Frequency Analysis ◽  
High Frequency ◽  
Small Signal

MONTE CARLO SIMULATIONS OF ELECTRON DRIFT VELOCITIES IN THE NOBLE GASES AND THEIR MIXTURES

1979 ◽  
Vol 40 (C7) ◽  
pp. C7-63-C7-64
Author(s):  
A. J. Davies ◽  
J. Dutton ◽  
C. J. Evans ◽  
A. Goodings ◽  
P.K. Stewart
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Noble Gases ◽  
Electron Drift

Monte Carlo Simulations of Photon Specific Absorbed Fractions in a Mouse Voxel Phantom

2011 ◽  
Vol 1 (0) ◽  
pp. 126-129 ◽  
Author(s):  
Akram MOHAMMADI ◽  
Sakae KINASE
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Voxel Phantom
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