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Implicit solvation
Results: 47

#	Item
31	Simbios Multiscale Strategy Statement Add to Reading List Source URL: simbios.stanford.edu Language: English - Date: 2009-09-08 13:50:41 Computational chemistry Multiscale modeling Operations research Molecular dynamics Scientific modelling Force field National Institute of General Medical Sciences Implicit solvation Simulation Chemistry Molecular modelling Science
32	Thomas W. Shattuck Department of Chemistry Colby College Waterville, Maine 04901 2 Add to Reading List Source URL: www.colby.edu Language: English - Date: 2013-04-19 09:13:32 Stereochemistry Computational chemistry Physical organic chemistry Alkane stereochemistry Force field Molecular mechanics Strain Van der Waals force Implicit solvation Chemistry Intermolecular forces Molecular modelling
33	ARTICLE pubs.acs.org/jcim Anisotropic Solvent Model of the Lipid Bilayer. 2. Energetics of Insertion of Small Molecules, Peptides, and Proteins in Membranes Andrei L. Lomize,* Irina D. Pogozheva, and Henry I Mosberg Add to Reading List Source URL: opm.phar.umich.edu Language: English - Date: 2011-07-19 15:53:28 Implicit solvation Lipid bilayer Membrane protein Hydrophobic mismatch Peripheral membrane protein Cell membrane Hydrophobicity scales Hydrophobic effect Orientations of Proteins in Membranes database Biology Membrane biology Chemistry
34	PDF Document Add to Reading List Source URL: www.modern-medical-science.site88.net Language: English - Date: 2013-02-01 19:54:29 Physics Molecular modelling Molecular dynamics Statistical mechanics Dynamical systems Langevin dynamics CHARMM Transition path sampling Implicit solvation Chemistry Computational chemistry Science
35	Tools and Methods for Multiscale Biomolecular Simulations Celeste Sagui Department of Physics, NC State University, Raleigh, NC Outline Add to Reading List Source URL: www.mcc.uiuc.edu Language: English - Date: 2011-12-30 23:13:08 Theoretical chemistry Multigrid method Numerical analysis Force field Ewald summation Implicit solvation Ab initio quantum chemistry methods Density functional theory AMBER Chemistry Computational chemistry Molecular modelling
36	PROTEINS: Structure, Function, and Genetics 47:393– [removed]Increasing the Precision of Comparative Models with YASARA NOVA—a Self-Parameterizing Force Field Elmar Krieger,1 Gu ¨ nther Koraimann,2 and Gert Vrien Add to Reading List Source URL: www.yasara.org Language: English - Date: 2004-06-21 08:25:51 Molecular modelling Intermolecular forces Protein structure Force fields Homology modeling Implicit solvation Root-mean-square deviation Molecular dynamics AMBER Chemistry Science Computational chemistry
37	Simulation of Protein Folding (With an emphasize on categorizing the different protein folding models) Add to Reading List Source URL: www.chem.utoronto.ca Language: English - Date: 2004-04-11 18:50:34 Biochemistry Protein folding Protein structure prediction Implicit solvation Protein domain Hydrophobic-polar protein folding model Alpha helix Protein Folding Protein structure Chemistry Biology
38	Integrated Tools for Computational Chemical Dynamics (PNNL) October 2010 Add to Reading List Source URL: t1.chem.umn.edu Language: English - Date: 2011-07-05 23:52:49 Computational chemistry Density functional theory Theoretical chemistry NWChem Implicit solvation Q-Chem CP2K Adsorption Chemistry Science Molecular modelling
39	Conformational analysis of 2,2-difluoroethylamine hydrochloride: double gauche effect Josué M. Silla1, Claudimar J. Duarte2, Rodrigo A. Cormanich2, Add to Reading List Source URL: www.ncbi.nlm.nih.gov Language: English Gauche effect Alkane stereochemistry Conformational isomerism Hyperconjugation Fluorine Hydrogen bond Implicit solvation Carbon–fluorine bond Chemistry Stereochemistry Physical organic chemistry
40	The Ionization Constant of Water over Wide Ranges of Temperature and Density Andrei V. Bandura Add to Reading List Source URL: www.nist.gov Language: English - Date: 2008-06-09 10:19:05 Equilibrium constant Acid dissociation constant Temperature PH Ion-association Solvation Equation of state Ideal gas Implicit solvation Chemistry Equilibrium chemistry Chemical equilibrium

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