Reaction coordinate

Results: 8



#Item
1Chemistry / 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
2Computational chemistry / Monte Carlo methods / Theoretical chemistry / Molecular dynamics / Stochastic simulation / Transition path sampling / Thermodynamic integration / Reaction coordinate / Dynamical system / Importance sampling / TPS / Phase space

Eur. Phys. J. Special Topics 224, 2409–) © EDP Sciences, Springer-Verlag 2015 DOI: epjst/e2015THE EUROPEAN PHYSICAL JOURNAL

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

Language: English - Date: 2015-09-23 02:32:54
3Disinfectants / Hydrogen peroxide / Alkene / Alkyne / Reaction coordinate / Chemistry / Functional groups / Physical chemistry

Massachusetts Institute of Technology Dr. Kimberly L. Berkowski 5.12, SpringOrganic Chemistry

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Source URL: www.chemistry2011.org

Language: English - Date: 2013-03-07 20:42:54
4Computational chemistry / Nuclear magnetic resonance / Molecular physics / Operations research / Theoretical chemistry / Biomarker / Energy profile / Reaction coordinate / Mathematical optimization / Chemistry / Science / Physics

Optimal Reaction Coordinate as a Biomarker for the Dynamics of Recovery from Kidney Transplant Sergei V. Krivov1,2*, Hayley Fenton3, Paul J. Goldsmith4, Rajendra K. Prasad4, Julie Fisher2,3, Emanuele Paci1,2 1 School of

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Source URL: www.plos.org

Language: English - Date: 2014-06-18 13:21:33
5Education / Educational psychology / Tests / Standardized tests / Multiple choice / Toluene / Trinitrotoluene / Explosive material / Chemical reaction / Chemistry / Science / Psychometrics

Chem30_05 reaction coordinate exemplar

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Source URL: www.education.alberta.ca

Language: English - Date: 2012-11-30 11:01:55
6Education / Educational psychology / Tests / Standardized tests / Multiple choice / Toluene / Trinitrotoluene / Explosive material / Chemical reaction / Chemistry / Science / Psychometrics

Chem30_05 reaction coordinate exemplar

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Source URL: education.alberta.ca

Language: English - Date: 2012-11-30 11:01:55
7Mathematical physics / Polar coordinate system / Reaction–diffusion system / Eigenvalues and eigenvectors / Nonlinear system / Dispersion / Algebra / Mathematics / Calculus

SIAM J. APPL. MATH. Vol. 57, No. 6, pp. 1485–1509, December 1997 c 1997 Society for Industrial and Applied Mathematics

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Source URL: people.maths.ox.ac.uk

Language: English - Date: 2006-06-29 10:19:46
8Matter / Ferrihydrite / Chemistry / Crystal

that for the (0, 00)g pair, in accord with the theoretical prediction of a strong curvature coupling of this mode to the reaction coordinate (26–28). To reconcile these seemingly conflicting predictions, the experimental results suggest that the

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Source URL: www.pharmazie.uni-muenchen.de

Language: English - Date: 2010-07-12 03:36:51
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