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Journal of Computational Chemistry
Results: 126

#	Item
81	Click Here JOURNAL OF GEOPHYSICAL RESEARCH, VOL. 111, D23304, doi:[removed]2006JD007325, 2006 for Add to Reading List Source URL: www.ace.uwaterloo.ca Language: English - Date: 2006-12-18 10:27:18 Climate forcing Computational science Global climate model Global warming Environmental chemistry Climate model Atmospheric convection Cloud Ozone Atmospheric sciences Meteorology Atmospheric thermodynamics
82	THE JOURNAL OF CHEMICAL PHYSICS 130, 234702 共2009兲 Interfacial water: A first principles molecular dynamics study of a nanoscale water film on salt Li-Min Liu,1 Matthias Krack,2 and Angelos Michaelides1,a兲 1 Add to Reading List Source URL: www.chem.ucl.ac.uk Language: English - Date: 2009-07-10 04:36:28 Inorganic solvents Oxides Neutron moderators Properties of water Dissolution Hydrogen bond Chemical bond Adsorption Water model Chemistry Computational chemistry Water
83	Journal of Computational Physics[removed]–2681 Contents lists available at SciVerse ScienceDirect Journal of Computational Physics journal homepage: www.elsevier.com/locate/jcp Add to Reading List Source URL: www.cse-lab.ethz.ch Language: English - Date: 2013-02-13 09:19:10 Computational fluid dynamics Computational physics Molecular modelling Multiscale modeling Dissipative particle dynamics Molecular dynamics Carbon nanotube Fullerene Scientific modelling Chemistry Matter Physics
84	Journal of Computational Physics xxx[removed]xxx–xxx Contents lists available at SciVerse ScienceDirect Journal of Computational Physics journal homepage: www.elsevier.com/locate/jcp Add to Reading List Source URL: www.cse-lab.ethz.ch Language: English - Date: 2013-02-07 13:15:17 Probability and statistics Monte Carlo methods Statistical mechanics Computational physics Computational chemistry Stochastic simulation Gillespie algorithm Kinetic Monte Carlo Static single assignment form Stochastic processes Statistics Applied mathematics
85	Journal of Molecular Liquids[removed]–113 Contents lists available at ScienceDirect Journal of Molecular Liquids journal homepage: www.elsevier.com/locate/molliq Add to Reading List Source URL: www.cse-lab.ethz.ch Language: English - Date: 2014-09-01 07:51:12 Molecular modelling Condensed matter physics Colloidal chemistry Silicon dioxide Water model Properties of water Colloid Solubility Force field Chemistry Water Computational chemistry
86	Hindawi Publishing Corporation Journal of Atomic, Molecular, and Optical Physics Volume 2012, Article ID[removed], 14 pages doi:[removed][removed]Review Article Add to Reading List Source URL: downloads.hindawi.com Language: English - Date: 2014-05-08 04:22:25 Chemical kinetics Theoretical chemistry Kinetic Monte Carlo Energy Transition state Metastability Metadynamics Periodic boundary conditions Protein folding Chemistry Computational chemistry Molecular dynamics
87	SciDAC 2008 Journal of Physics: Conference Series[removed][removed]IOP Publishing doi:[removed][removed] Add to Reading List Source URL: bioenergycenter.org Language: English - Date: 2010-03-01 16:52:02 Intermolecular forces Molecular physics Papermaking Force field Lignin CHARMM Molecular dynamics Molecular mechanics Ether Chemistry Molecular modelling Computational chemistry
88	Prof. Vincenzo Barone, FRSC IDEA virtual lab – In-Silico Developments for Emerging Applications Work address: Scuola Normale Superiore di Pisa Piazza dei Cavalieri[removed]Pisa, Italy Tel: +[removed]Fax: +39 05 Add to Reading List Source URL: hubmiur.pubblica.istruzione.it Language: English - Date: 2014-09-17 04:51:28 Physical Chemistry Chemical Physics Pisa University of Pisa Computational chemistry Fellows of the Royal Society Year of birth missing Rutherford Aris bibliography Chemistry Journal of Physical Chemistry A Scuola Normale Superiore di Pisa
89	Hilbig and Rarey Journal of Cheminformatics 2012, 4(Suppl 1):O4 http://www.jcheminf.com/content/4/S1/O4 ORAL PRESENTATION Open Access Add to Reading List Source URL: www.jcheminf.com Language: English Chemistry Computational chemistry Bioinformatics Virtual screening Drug discovery Science Cheminformatics
90	THE JOURNAL OF CHEMICAL PHYSICS 123, 084314 共2005兲 A hierarchical family of three-dimensional potential energy surfaces for He-CO Kirk A. Petersona兲 Department of Chemistry, Washington State University, Pullman, W Add to Reading List Source URL: faculty.gvsu.edu Language: English - Date: 2013-11-26 13:46:48 Coupled cluster Basis set Density functional theory Chemistry Theoretical chemistry Computational chemistry

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