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Implicit solvation
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Implicit solvation - Taschenbuch

ISBN: 6130233175

Gebundene Ausgabe, ID: 5943391

Poisson-Boltzmann equation, Molecular dynamics, Molecular mechanics, Water model, Force field (chemistry), Force field implementation, Poisson's equation, Accessible surface area - Buch, gebundene Ausgabe, 68 S., Beilagen: Paperback, Erschienen: 2009 Alphascript Publishing Implicit solvation is a method of representing solvent as a continuous medium instead of individual explicit solvent molecules most often used in molecular dynamics simulations and in other applications of molecular mechanics. The method is often applied to estimate free energy of solute-solvent interactions in structural and chemical processes, such as folding or conformational transitions of proteins, DNA, RNA, and polysaccharides, association of biological macromolecules with ligands, or transport of drugs across biological membranes. The implicit solvation model is justified in liquids, where the potential of mean force can be applied to approximate the averaged behavior of many highly dynamic solvent molecules. However, the interiors of biological membranes or proteins can also be considered as media with specific solvation or dielectric properties. These media are continuous but not necessarily uniform, since their properties can be described by different analytical functions, such as polarity profiles of lipid bilayers

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Implicit solvation - Herausgeber: McBrewster, John, Miller, Frederic P., Vandome, Agnes F.
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Herausgeber: McBrewster, John, Miller, Frederic P., Vandome, Agnes F.:

Implicit solvation - Taschenbuch

2009, ISBN: 9786130233174

[ED: Softcover], [PU: Alphascript Publishing], Implicit solvation is a method of representing solvent as a continuous medium instead of individual explicit solvent molecules most often used in molecular dynamics simulations and in other applications of molecular mechanics. The method is often applied to estimate free energy of solute-solvent interactions in structural and chemical processes, such as folding or conformational transitions of proteins, DNA, RNA, and polysaccharides, association of biological macromolecules with ligands, or transport of drugs across biological membranes. The implicit solvation model is justified in liquids, where the potential of mean force can be applied to approximate the averaged behavior of many highly dynamic solvent molecules. However, the interiors of biological membranes or proteins can also be considered as media with specific solvation or dielectric properties. These media are continuous but not necessarily uniform, since their properties can be described by different analytical functions, such as polarity profiles of lipid bilayers2009. 68 S.Versandfertig in 3-5 Tagen, [SC: 0.00]

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Implicit solvation
Autor:

Herausgeber: McBrewster, John, Miller, Frederic P., Vandome, Agnes F.

Titel:

Implicit solvation

ISBN-Nummer:

9786130233174

Implicit solvation is a method of representing solvent as a continuous medium instead of individual explicit solvent molecules most often used in molecular dynamics simulations and in other applications of molecular mechanics. The method is often applied to estimate free energy of solute-solvent interactions in structural and chemical processes, such as folding or conformational transitions of proteins, DNA, RNA, and polysaccharides, association of biological macromolecules with ligands, or transport of drugs across biological membranes. The implicit solvation model is justified in liquids, where the potential of mean force can be applied to approximate the averaged behavior of many highly dynamic solvent molecules. However, the interiors of biological membranes or proteins can also be considered as media with specific solvation or dielectric properties. These media are continuous but not necessarily uniform, since their properties can be described by different analytical functions, such as polarity profiles of lipid bilayers

Detailangaben zum Buch - Implicit solvation


EAN (ISBN-13): 9786130233174
ISBN (ISBN-10): 6130233175
Gebundene Ausgabe
Taschenbuch
Erscheinungsjahr: 2009

Buch in der Datenbank seit 27.03.2008 16:38:56
Buch zuletzt gefunden am 30.01.2012 09:22:32
ISBN/EAN: 9786130233174

ISBN - alternative Schreibweisen:
613-0-23317-5, 978-613-0-23317-4

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