Modeling water, the hydrophobic effect, and ion solvation.
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Crystal Structure of human pyridoxal kinase: structural basis of M(+) and M(2+) activationBiomolecular electrostatics and solvation: a computational perspectiveDesign and application of implicit solvent models in biomolecular simulationsProtein–Ligand Interactions: Thermodynamic Effects Associated with Increasing Nonpolar Surface AreaProtein–ligand interactions: Probing the energetics of a putative cation–π interactionStatistical analysis of crystallization database links protein physico-chemical features with crystallization mechanismsTowards a structural biology of the hydrophobic effect in protein foldingSelf-Assembly of Amphiphilic Block Copolypeptoids - Micelles, Worms and PolymersomesWater PMF for predicting the properties of water molecules in protein binding site.Coping with thermal challenges: physiological adaptations to environmental temperatures.Ion cooperativity and the effect of salts on polypeptide structure--a molecular dynamics study of BBA5 in salt solutions.Free energetics of rigid body association of ubiquitin binding domains: a biochemical model for binding mediated by hydrophobic interaction.Interfacial water at protein surfaces: wide-line NMR and DSC characterization of hydration in ubiquitin solutions.DNA duplex stability: the role of preorganized electrostatics.Solid-state ²H NMR shows equivalence of dehydration and osmotic pressures in lipid membrane deformation.Targeting Peroxisome Proliferator-Activated Receptors Using Thiazolidinediones: Strategy for Design of Novel Antidiabetic DrugsThe hydrophobic effect in a simple isotropic water-like model: Monte Carlo studyStatistical determinants of selective ionic complexation: ions in solvent, transport proteins, and other "hosts".Synergy of aromatic residues and phosphoserines within the intrinsically disordered DNA-binding inhibitory elements of the Ets-1 transcription factorBioinformatics and molecular modeling in glycobiology.Molecular simulation of water and hydration effects in different environments: challenges and developments for DFTB based modelsMinimizing frustration by folding in an aqueous environmentPoint charges optimally placed to represent the multipole expansion of charge distributions.Effects of select anions from the Hofmeister series on the gas-phase conformations of protein ions measured with traveling-wave ion mobility spectrometry/mass spectrometry.Curvature and hydrophobic forces drive oligomerization and modulate activity of rhodopsin in membranes.Dissecting hydrophobicity.A Density Functional Theory Evaluation of Hydrophobic Solvation: Ne, Ar and Kr in a 50-Water Cluster. Implications for the Hydrophobic Effect.A self-consistent phase-field approach to implicit solvation of charged molecules with Poisson-Boltzmann electrostatics.Heat capacity changes associated with nucleic acid folding.The conformational ensembles of α-synuclein and tau: combining single-molecule FRET and simulations.The Hydrophobic Effect in Solute Partitioning and Interfacial Tension.Role of Na+ and K+ in enzyme function.Effects of temperature and salt concentration on the structural stability of human lymphotactin: insights from molecular simulationsAssociation of helical beta-peptides and their aggregation behavior from the potential of mean force in explicit solventDewetting and hydrophobic interaction in physical and biological systems.Protein-Ligand Interactions: Thermodynamic Effects Associated with Increasing the Length of an Alkyl Chain.Curvature forces in membrane lipid-protein interactions.Origin of hydrophobicity and enhanced water hydrogen bond strength near purely hydrophobic solutes.Automated optimization of water-water interaction parameters for a coarse-grained model.A medicinal chemist's guide to molecular interactions
P2860
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P2860
Modeling water, the hydrophobic effect, and ion solvation.
description
2005 nî lūn-bûn
@nan
2005年の論文
@ja
2005年学术文章
@wuu
2005年学术文章
@zh-cn
2005年学术文章
@zh-hans
2005年学术文章
@zh-my
2005年学术文章
@zh-sg
2005年學術文章
@yue
2005年學術文章
@zh
2005年學術文章
@zh-hant
name
Modeling water, the hydrophobic effect, and ion solvation.
@ast
Modeling water, the hydrophobic effect, and ion solvation.
@en
type
label
Modeling water, the hydrophobic effect, and ion solvation.
@ast
Modeling water, the hydrophobic effect, and ion solvation.
@en
prefLabel
Modeling water, the hydrophobic effect, and ion solvation.
@ast
Modeling water, the hydrophobic effect, and ion solvation.
@en
P2093
P1476
Modeling water, the hydrophobic effect, and ion solvation.
@en
P2093
Barbara Hribar-Lee
Ken A Dill
Thomas M Truskett
Vojko Vlachy
P304
P356
10.1146/ANNUREV.BIOPHYS.34.040204.144517
P577
2005-01-01T00:00:00Z