The Poisson-Boltzmann equation for biomolecular electrostatics: a tool for structural biology
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A decoy set for the thermostable subdomain from chicken villin headpiece, comparison of different free energy estimators.Bridging scales through multiscale modeling: a case study on protein kinase ABiomolecular electrostatics and solvation: a computational perspectiveMotion and flexibility in human cytochrome p450 aromataseDiffusion, crowding & protein stability in a dynamic molecular model of the bacterial cytoplasmHydrophobic Surface Burial Is the Major Stability Determinant of a Flat, Single-layer β-SheetNMR spectroscopy and molecular dynamics simulation of r(CCGCUGCGG)₂ reveal a dynamic UU internal loop found in myotonic dystrophy type 1.Computation of electrostatic forces between solvated molecules determined by the Poisson-Boltzmann equation using a boundary element methodSynaptotagmin-1 binds to PIP(2)-containing membrane but not to SNAREs at physiological ionic strengthTransmembrane domains of attraction on the TSH receptor.Progress in developing Poisson-Boltzmann equation solvers.Membrane Protein Properties Revealed through Data-Rich Electrostatics Calculations.Recent advances in computer-aided drug design.pH-dependent association of proteins. The test case of monoclonal antibody HyHEL-5 and its antigen hen egg white lysozymeBioDrugScreen: a computational drug design resource for ranking molecules docked to the human proteomeDifferential geometry based solvation model I: Eulerian formulation.Bluues: a program for the analysis of the electrostatic properties of proteins based on generalized Born radii.Molecular mechanism of MBX2319 inhibition of Escherichia coli AcrB multidrug efflux pump and comparison with other inhibitorsNew Versions of Image Approximations to the Ionic Solvent Induced Reaction Field.Properties of the Nucleic-acid Bases in Free and Watson-Crick Hydrogen-bonded States: Computational Insights into the Sequence-dependent Features of Double-helical DNARole of E542 and E545 missense mutations of PIK3CA in breast cancer: a comparative computational approach.Role of large thermal fluctuations and magnesium ions in t-RNA selectivity of the ribosome.Differential geometry based solvation model II: Lagrangian formulation.KECSA-Movable Type Implicit Solvation Model (KMTISM).The selectivity and promiscuity of brain-neuroregenerative inhibitors between ROCK1 and ROCK2 isoforms: An integration of SB-QSSR modelling, QM/MM analysis and in vitro kinase assay.Protein side chain conformation predictions with an MMGBSA energy function.Predicting nonspecific ion binding using DelPhi.A self-consistent phase-field approach to implicit solvation of charged molecules with Poisson-Boltzmann electrostatics.Beyond Antibodies: Development of a Novel Protein Scaffold Based on Human Chaperonin 10.Electrostatic Similarity Analysis of Human β-Defensin Binding in the Melanocortin SystemA method to determine dielectric constants in nonhomogeneous systems: application to biological membranesExtending the Fast Multipole Method for Charges inside a Dielectric Sphere in an Ionic Solvent: High Order Image Approximations for Reaction FieldsA paramagnetic molecular voltmeter.MEAN-FIELD THEORY AND COMPUTATION OF ELECTROSTATICS WITH IONIC CONCENTRATION DEPENDENT DIELECTRICSImage Charge Method for Reaction Fields in a Hybrid Ion-Channel ModelBetween algorithm and model: different Molecular Surface definitions for the Poisson-Boltzmann based electrostatic characterization of biomolecules in solutionYukawa-Field Approximation of Electrostatic Free Energy and Dielectric Boundary Force.Competitive adsorption and ordered packing of counterions near highly charged surfaces: From mean-field theory to Monte Carlo simulations.Mean-field description of ionic size effects with nonuniform ionic sizes: a numerical approachDielectric Boundary Force in Molecular Solvation with the Poisson-Boltzmann Free Energy: A Shape Derivative Approach
P2860
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P2860
The Poisson-Boltzmann equation for biomolecular electrostatics: a tool for structural biology
description
2002 nî lūn-bûn
@nan
2002 թուականին հրատարակուած գիտական յօդուած
@hyw
2002 թվականին հրատարակված գիտական հոդված
@hy
2002年の論文
@ja
2002年論文
@yue
2002年論文
@zh-hant
2002年論文
@zh-hk
2002年論文
@zh-mo
2002年論文
@zh-tw
2002年论文
@wuu
name
The Poisson-Boltzmann equation ...... a tool for structural biology
@ast
The Poisson-Boltzmann equation ...... a tool for structural biology
@en
The Poisson-Boltzmann equation ...... a tool for structural biology
@nl
type
label
The Poisson-Boltzmann equation ...... a tool for structural biology
@ast
The Poisson-Boltzmann equation ...... a tool for structural biology
@en
The Poisson-Boltzmann equation ...... a tool for structural biology
@nl
prefLabel
The Poisson-Boltzmann equation ...... a tool for structural biology
@ast
The Poisson-Boltzmann equation ...... a tool for structural biology
@en
The Poisson-Boltzmann equation ...... a tool for structural biology
@nl
P2860
P356
P1476
The Poisson-Boltzmann equation ...... a tool for structural biology
@en
P2093
P2860
P304
P356
10.1002/JMR.577
P407
P577
2002-01-01T00:00:00Z