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Molecular mechanics
Results: 397

#	Item
51	First-Passage Monte Carlo: Hydrogen transport in damaged tungsten U. von Toussaint, T. Schwarz-Selinger Max-Planck-Institut für Plasmaphysik, Garching, Germany Add to Reading List Source URL: psi2014.nifs.ac.jp Language: English - Date: 2014-07-07 20:13:51 Partial differential equations Chemistry Quantum mechanics Diffusion equation Reaction–diffusion system Molecular diffusion Random walk Tritium Physics Diffusion Mathematical analysis
52	The Single-Atom Transistor: perspectives for quantum electronics on the atomic-scale Add to Reading List Source URL: aph-ags.webarchiv.kit.edu Language: English - Date: 2012-04-26 10:17:47 Nanotechnology Nanoelectronics Quantum point contact Transistor Quantum mechanics Conductance quantum Molecular scale electronics Quantum electronics Electronics Physics
53	Microsoft Word - Figure_3.vsdmip.doc Add to Reading List Source URL: ub.cbm.uam.es Language: English - Date: 2015-05-25 09:53:34 Computational chemistry Drug discovery Bioinformatics Protein structure Docking Drug design Molecular mechanics Virtual screening Ligand Chemistry Science Molecular modelling
54	Workshop on Nanoscience for Solar Energy ConversionOctoberDynamics on the Nanoscale: Time-domain ab initio studies of quantum dots and Add to Reading List Source URL: portal.ictp.it Language: English - Date: 2009-09-14 11:24:41 Quantum mechanics Theoretical chemistry Computational chemistry Molecular dynamics Molecular modelling Diabatic Carbon nanotube Chemistry Physics Quantum chemistry
55	Errata for first printing of Statistical Mechanics: Theory and Molecular Simulation Mark E. Tuckerman February 19, 2013 The following is a list of the most important corrections to the first printing of the book Statist Add to Reading List Source URL: www.nyu.edu Language: English - Date: 2013-02-23 22:10:44
56	International Center for Numerical Methods in Engineering CIMNE Congress Bureau Campus Nord UPC, Building C3 - “Zona Comercial” Jordi Girona, ), Barcelona, Spain Tel. +Fax +p Add to Reading List Source URL: congress.cimne.com Language: English - Date: 2014-06-26 11:08:12 Science Material Point Method Particle Meshfree methods Molecular dynamics Computational mechanics Quantum mechanics Smoothed-particle hydrodynamics Discrete element method Computational fluid dynamics Computational science Physics
57	Scalable Time-Parallelization of Molecular Dynamics Simulations in Nano Mechanics Yanan Yu Ashok Srinivasan Add to Reading List Source URL: www.cs.fsu.edu Language: English - Date: 2006-05-09 11:13:56 Parallel computing Applied mathematics Scientific modeling Molecular dynamics Molecular modelling Theoretical computer science Automatic parallelization Speedup Simulation Computational chemistry Computing Science
58	Errata for second printing of Statistical Mechanics: Theory and Molecular Simulation Mark E. Tuckerman February 19, 2013 The following is a list of the most important corrections to the second printing of the book Stati Add to Reading List Source URL: www.nyu.edu Language: English - Date: 2013-02-23 22:10:39
59	Recent publications by CTCC members Issue 3, 2012 A combined quantum mechanics/molecular mechanics study of the one- and two-photon absorption in the green fluorescent protein A.H.Steindal, J.M.H.Olsen, K.Ruud, L.Fredian Add to Reading List Source URL: www.ctcc.no
60	IUPAC Gold Book - quantum mechanics/molecular mechanics Add to Reading List Source URL: goldbook.iupac.org - Date: 2014-02-24 06:20:26