Molecular dynamics

Results: 1160



#Item
51Chemistry / Nature / Chemical bonding / Quantum chemistry / Computational chemistry / Molecular modelling / Atomic orbital / Molecular geometry / Molecular orbital / Molecular dynamics / Spartan / Crystal

ODYSSEY SPARTAN STUDENT EDITION Platforms

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Source URL: www.wavefun.com

Language: English - Date: 2015-12-09 17:52:12
52Physics / Chemistry / Nature / Condensed matter physics / Physical quantities / Thermodynamic properties / Heat transfer / Thermodynamics / Thermal conductivity / Amorphous silicon / Amorphous solid / Wavelet

MODE RESOLVED THERMAL TRANSPORT IN AMORPHOUS SILICON: A MOLECULAR DYNAMICS STUDY Christopher H. Baker and Pamela M. Norris Department of Mechanical and Aerospace Engineering, University of Virginia, Charlottesville, Virg

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Source URL: www.vsgc.odu.edu

Language: English - Date: 2013-05-02 13:43:35
53Mathematical modeling / Chemistry / Multiscale modeling / Computational science / Computational chemistry / Molecular modelling / Nature / Molecular dynamics / Scientific modelling / Dissipative particle dynamics / Fluid mechanics / Coarse-grained modeling

EUROMATSymposia Structure/Area D Title: Multiscale Modeling of Materials Organizer Assoc. Prof. Karakasidis

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Source URL: euromat2017.fems.eu

Language: English - Date: 2016-07-08 09:56:28
54Chemistry / Nature / Computational chemistry / Polymer chemistry / Quantum chemistry / Polymer / Crystal / Reaction coordinate / Molecular dynamics / Phase transition

A string reaction coordinate for the folding of a polymer chain

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Source URL: comp-phys.univie.ac.at

Language: English - Date: 2015-09-23 05:25:00
55Chemistry / Computational chemistry / Computational science / Constraint algorithm / Molecular dynamics

THE JOURNAL OF CHEMICAL PHYSICS 126, 046101 共2007兲 A common, avoidable source of error in molecular dynamics integrators Ross A. Lippert, Kevin J. Bowers, Ron O. Dror, Michael P. Eastwood, Brent A. Gregersen, John L

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Source URL: www.deshawresearch.com

Language: English - Date: 2010-09-27 16:06:44
56Scientific modeling / Computational chemistry / Computational science / Molecular dynamics / Molecular modelling / Verlet / Computer simulation / Periodic boundary conditions / Energy drift / Verlet integration

ABOUT MANUSCRIPTS FOR IJ ITA

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Source URL: foibg.com

Language: English - Date: 2015-02-02 08:47:14
57Scientific modeling / Business / Application software / Software / Computational chemistry / Operations research / Simulation / Simulation software / Computer simulation / Molecular dynamics / Training simulation

Microsoft Word - 10LiLiangjunFinal_07302013_2141.docx

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Source URL: www.ndia-mich.org

Language: English - Date: 2013-08-19 09:56:33
58Biology / Gene expression / Molecular biology / Cellular processes / Induced stem cells / Cellular differentiation / Developmental biology / Gene regulatory network / Ridge / Gene

PERSPECTIVES SYSTEMS BIOLOGY Attractors and Democratic Dynamics

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Source URL: debivort.org

Language: English - Date: 2009-09-07 21:44:07
59Computational chemistry / Nature / Molecular dynamics / Molecular modelling / Simulation / Biophysics / Science / Applied mathematics

Applications are invited for fully funded scholarships in our collaborators at Kings College, Department of Chemistry. The successful applicant will start in September 2016 in the Rosta group. Project title: Statisticall

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Source URL: www.np.phy.cam.ac.uk

Language: English
60Chemistry / Physics / Tandem mass spectrometry / Spectroscopy / Molecular physics / Photons / Collision-induced dissociation / Bond-dissociation energy / Fragmentation / Photodissociation / X-ray photoelectron spectroscopy / Xenon monochloride

THE JOURNAL OF CHEMICAL PHYSICS 134, Two- and three-body photodissociation dynamics of diiodobromide (I2 Br− ) anion Paul E. Crider, Aaron W. Harrison, and Daniel M. Neumarka) Department of Chemistry, Un

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Source URL: bromine.cchem.berkeley.edu

Language: English - Date: 2011-04-06 11:49:27
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