Molecular dynamics

Results: 1160



#Item
391Applied mathematics / Systems biology / Bioengineering / Mathematical and theoretical biology / Granularity / Molecular dynamics / Metabolism / Flux / Biological network / Science / Bioinformatics / Biology

‫‪School of Biological Sciences Weekly Seminar‬‬ ‫ﺑﺮﻧﺎﻣﻪ ﺳﻤﯿﻨﺎرﻫﺎي ﻫﻔﺘﮕﯽ ﺑﻬﺎره ﭘﮋوﻫﺸﮑﺪه ﻋﻠﻮم زﯾﺴﺘﯽ ﺳﺎل ‪1394‬‬ ‫ﺳﺎز

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Source URL: bs.ipm.ac.ir

Language: English - Date: 2015-04-14 03:33:45
392Water dimer / Supramolecular chemistry / Water cluster / Hydrogen bond / Properties of water / Crystal / Richard J. Saykally / Molecular dynamics / Chemistry / Cluster chemistry / Physical chemistry

Water clusters: Untangling the mysteries of the liquid, one molecule at a time Frank N. Keutsch* and Richard J. Saykally† Department of Chemistry, University of California, Berkeley, CAThis contribution is

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Source URL: www.pnas.org

Language: English - Date: 2011-03-28 23:41:51
393Nuclear magnetic resonance / Molecular modelling / Spectroscopy / Molecular dynamics / Force field / Chemical shift / Quantum chemistry / Chemistry / Physics / Science

Exner et al. Journal of Cheminformatics 2014, 6(Suppl 1):O2 http://www.jcheminf.com/content/6/S1/O2 ORAL PRESENTATION Open Access

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Source URL: www.jcheminf.com

Language: English
394Monte Carlo method / Numerical analysis / Probabilistic complexity theory / Sensitivity analysis / Analysis / KAERI / Uncertainty analysis / CANDU reactor / Molecular dynamics / Science / Probability and statistics / Knowledge

Prospects of Next Generation Safety Analysis Code and Experience of high performance computingPresented for SNA+MC2013 Workshop in Paris, France Bub Dong Chung1)

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Source URL: www.gen-4.org

Language: English - Date: 2014-06-18 05:44:51
395Cybernetics / Genetics / Dissipative particle dynamics / Soft matter / Genetic algorithm / Molecular dynamics / Chemical bond / Evolutionary algorithm / DNA / Chemistry / Science / Biology

Evolutionary design of a DDPD model of ligation Mark A. Bedau1,2,3,6 Andrew Buchanan1,2 Gianluca Gazzola1,2 Martin Hanczyc1,2 Thomas Maeke4,2

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Source URL: people.reed.edu

Language: English - Date: 2008-02-29 16:32:26
396Theoretical chemistry / Dye-sensitized solar cells / Ultraviolet radiation / Crystal / Time-dependent density functional theory / Molecular orbital / Titanium dioxide / Chemistry / Computational chemistry / Quantum chemistry

J. Phys. Chem. C 2008, 112, 16655–Real-Time Propagation of the Reduced One-Electron Density Matrix in Atom-Centered Orbitals: Application to Electron Injection Dynamics in Dye-Sensitized TiO2 Clusters

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Source URL: yangtze.hku.hk

Language: English - Date: 2010-12-19 08:35:07
397Computational biology / Computational genomics / Molecular dynamics / Biological database / Bioimage informatics / Charles Lawrence / Bioinformatics / Science / Computational science

BioMed Research International Special Issue on High Performance Computing for Biological Data Analysis and Molecular Dynamics CALL FOR PAPERS

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Source URL: downloads.hindawi.com

Language: English - Date: 2015-01-29 02:31:12
398Science / Theoretical chemistry / Molecular dynamics / NAMD / AutoDock / Heuristic / Simulation / Molecular modelling / Chemistry / Computational chemistry

CALIFORNIA STATE SCIENCE FAIR 2015 PROJECT SUMMARY Name(s) Project Number

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Source URL: www.usc.edu

Language: English - Date: 2015-04-07 11:47:36
399Electronvolt / Relaxation / Temperature / Equipartition theorem / Thermal bath / Kinetic theory / Physics / Thermodynamics / Carbon nanotube

PHYSICAL REVIEW B 75, 195445 共2007兲 Thermally driven large-amplitude fluctuations in carbon-nanotube-based devices: Molecular dynamics simulations Zhiping Xu and Quan-Shui Zheng Department of Engineering Mechanics,

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Source URL: yangtze.hku.hk

Language: English - Date: 2010-12-19 08:35:06
400Erich Sackmann / Lipid bilayer / Protein–lipid interaction / Biophysics / Molecular dynamics / Aarhus University / Risø DTU National Laboratory for Sustainable Energy / Soft matter / Membrane protein / Membrane biology / Biology / Chemistry

Curriculum vitae for Ole G. Mouritsen Department of Physics, Chemistry, and Pharmacy University of Southern Denmark

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Source URL: www.memphys.sdu.dk

Language: English - Date: 2012-12-06 03:32:40
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