Molecular dynamics

Results: 1160



#Item
511Molecular modelling / Computational chemistry / Bioinformatics / Protein structure / GROMACS / Molecular dynamics / Simulation / Scientific modelling / In silico / Software / Science / Chemistry

Microsoft PowerPoint - EvoGrid-poster.ppt

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Source URL: www.damer.com

Language: English - Date: 2011-07-01 07:01:43
512Organic semiconductors / Organic electronics / Organic field-effect transistor / Rubrene / Field-effect transistor / Transistor / Electronics / Molecular electronics / Electromagnetism

Principal Research Results Charge Dynamics at the Interface of Organic/Inorganic Composites: Best-performing Organic Field-effect Transistors Featuring Organic Crystalline Surfaces Background

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Source URL: criepi.denken.or.jp

Language: English - Date: 2008-09-29 03:21:08
513Fluid mechanics / Aerodynamics / Chemical engineering / Corrosion / Flow-accelerated corrosion / Molecular diffusion / Diffusion / FAC / Turbulence / Transport phenomena / Fluid dynamics / Physics

Principal Research Results Development of Prediction Model for Pipe Wall-Thinning by Flow Accelerated Corrosion (FAC) Background Management of pipe wall-thinning, especially Flow Accelerated Corrosion (FAC)* 1 of carb

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Source URL: criepi.denken.or.jp

Language: English - Date: 2010-02-04 23:04:35
514Explicit and implicit methods / Computational science / Runge–Kutta methods / Simulation / Computer simulation / MEMO Model / Applied mathematics / Molecular dynamics / Material Point Method / Mathematics / Science / Numerical methods for ordinary differential equations

Engineers develop new methods to speed up simulations in computational grand challenge

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Source URL: phys.org

Language: English - Date: 2015-04-15 01:23:23
515Fluid mechanics / Aerodynamics / Wind tunnel / Wind / Molecular diffusion / Atmospheric sciences / Meteorology / Fluid dynamics

Principal Research Results Development of Numerical Model for Atmospheric Diffusion of Stack Gas from Nuclear Power Stations Background It is necessary to construct more nuclear power stations to realize a low-carbon so

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Source URL: criepi.denken.or.jp

Language: English - Date: 2010-02-04 23:04:34
516Time / Molecular nanotechnology / K. Eric Drexler / Productive nanosystems / Molecular dynamics / Computer simulation / Molecular assembler / Foresight Institute Feynman Prize in Nanotechnology / Nanotechnology / Science / Technology

Copyright © 2006 American Scientific Publishers All rights reserved Printed in the United States of America Journal of Computational and Theoretical Nanoscience

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Source URL: e-drexler.com

Language: English - Date: 2006-04-04 17:16:18
517Protein domains / Enzymes / Metabolism / Proteins / Coenzymes / Biotin carboxylase / Biotin / Acetyl-CoA carboxylase / Pyruvate carboxylase / Chemistry / Biology / Biochemistry

J. Phys. Chem. B 2008, 112, [removed]Molecular Dynamics Simulations of Biotin Carboxylase Sten O. Nilsson Lill,*,† Jiali Gao,† and Grover L. Waldrop‡

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Source URL: www.dtc.umn.edu

Language: English - Date: 2012-08-16 12:29:04
518Molecular physics / Quantum chemistry / Intermolecular forces / Force field / Molecular dynamics / Molecular Hamiltonian / Quantum mechanics / Chemical bond / Molecular mechanics / Chemistry / Computational chemistry / Molecular modelling

1890 J. Chem. Theory Comput. 2007, 3, [removed]Design of a Next Generation Force Field: The X-POL Potential

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Source URL: www.dtc.umn.edu

Language: English - Date: 2012-08-16 12:29:04
519Science / Molecular modelling / Parallel computing / Intermolecular forces / Molecular physics / LAMMPS / Molecular dynamics / Blue Gene / NAMD / Chemistry / Computing / Computational chemistry

Bioinformatics Applications on Blue Gene Platforms:

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Source URL: www-03.ibm.com

Language: English - Date: 2012-11-21 10:26:11
520Central Research Institute of Electric Power Industry / Molecular dynamics / Light water reactor / Chemistry / Corrosion / Embrittlement

Annual Research Report 2006

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Source URL: criepi.denken.or.jp

Language: English - Date: 2008-09-29 03:32:28
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