Molecular dynamics

Results: 1160



#Item
341Systems biology / Biophysics / Molecular dynamics / Computational biology / Molecular modelling / Scientific modelling / Computer simulation / Evolution in Variable Environment / Neuroinformatics / Science / Bioinformatics / Biology

COMPUTING 4.0. Creating an Integrated Computational Environment for Biology 4.1. An Essential Foundation....................................................................................................................

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Source URL: genomicsgtl.energy.gov

Language: English - Date: 2010-11-30 14:43:12
342Glass / GROMACS / Boron / Chemistry / Matter / Dielectrics

A STRUCTURAL STUDY OF A MULTICOMPONENT E-CR GLASS VIA MOLECULAR DYNAMICS SIMULATION BY ANDREW J. LANPHERE ADVISOR: DR. ALASTAIR CORMACK

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Source URL: www.alfred.edu

Language: English - Date: 2015-04-15 13:57:15
343Physical quantities / Temperature / Materials science / State functions / Molecular dynamics / Melting point / Nucleation / Melting / Crystal / Chemistry / Physics / Phase transitions

THE JOURNAL OF CHEMICAL PHYSICS 135, The kinetics of homogeneous melting beyond the limit of superheating D. Alfè,1,2,3,4,a) C. Cazorla,5 and M. J. Gillan1,3,4 1

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Source URL: www.claudiocazorla.com

Language: English - Date: 2011-07-09 10:20:21
344Environmental chemistry / Materials science / Spectroscopy / Physics / X-ray absorption fine structure / Molecular dynamics / Simulation / Scientific modelling / Simula / Chemistry / Science / Condensed matter physics

Photon Factory Activity Report 2006 #24 Part BChemistry 27B/2006G090 XAFS data analysis of uranium dioxide by using MD simulation and FEFF

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Source URL: pfwww.kek.jp

Language: English - Date: 2010-01-05 10:33:33
345Nanomaterials / Emerging technologies / Graphene / Molecular dynamics / Adsorption / Physisorption / Chemisorption / Chemistry / Surface chemistry / Catalysis

Chemistry C. CAZORLA C. ROVIRA " $

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Source URL: www.claudiocazorla.com

Language: English - Date: 2013-10-19 05:03:15
346Atmospheric dynamics / Precipitation / Rain / Intertropical Convergence Zone / Tropical climate / Monsoon / Ice age / Proxy / Tropical cyclone / Atmospheric sciences / Meteorology / Climate

Julian P. Sachs is an associate professor of oceanography at the University of Washington. His laboratory focuses on developing and applying molecular and isotopic techniques to decipher climate, geochemical and biochemi

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Source URL: faculty.washington.edu

Language: English - Date: 2011-08-11 18:57:44
347Ionization / Mass spectrum / Photoelectron photoion coincidence spectroscopy / Photofragment-ion imaging / Chemistry / Mass spectrometry / Tandem mass spectrometry

Photon Factory Activity Report 2007 #25 Part BAtomic and Molecular Science 2C/2007G655 Photo-dissociation dynamics of halogenated aromatic molecules

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Source URL: pfwww.kek.jp

Language: English - Date: 2010-01-05 10:34:42
348Quantum electrodynamics / Mass spectrometry / Tandem mass spectrometry / Physical chemistry / Benzene / Electron / Chemical bond / Ion / Photon / Chemistry / Physics / Charge carriers

Photon Factory Activity Report 2008 #26 Part BAtomic and Molecular Science 2C, 28B/2007G655 Study of fragmentation dynamics of benzene and halegenized benzenes

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Source URL: pfwww.kek.jp

Language: English - Date: 2010-01-05 10:36:40
349Visual Molecular Dynamics / Collaboratory / NAMD / Visualization / Workbench / VisIt / Simulation / Protein Data Bank / Bioinformatics / Science / Software / Application software

BioCoRE: A Collaboratory for Structural Biology Milind Bhandarkar1,2 , Gila Budescu2 , William F. Humphrey5 , Jesus A. Izaguirre1,2 , Sergei Izrailev2,3 , Laxmikant V. Kale1,2 , Dorina Kosztin2,4 , Ferenc Molnar2 , James

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Source URL: www.ks.uiuc.edu

Language: English
350Computational chemistry / Enzyme inhibitor / Enzymes / Diphenyl ether / Mycolic acid / Molecular dynamics / Enzyme / Chemistry / Metabolism / Medicinal chemistry

Nagoya University Theoretical Chemistry Colloquium May 1, 2014 (Thu), 16:00-17:00 RCMS, 2nd floor, Chemistry Gallery Rational design of InhA inhibitors as highly potential antitubercular agents, based on computer aided m

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Source URL: www.rcms.nagoya-u.ac.jp

Language: English - Date: 2015-04-17 00:32:01
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