A new analysis of electrostatic free energy minimization and Poisson-Boltzmann equation for protein in ionic solvent
From MaRDI portal
(Redirected from Publication:457589)
Recommendations
- Minimization of Electrostatic Free Energy and the Poisson–Boltzmann Equation for Molecular Solvation with Implicit Solvent
- On the analysis and application of an ion size-modified Poisson-Boltzmann equation
- A nonlocal modified Poisson-Boltzmann equation and finite element solver for computing electrostatics of biomolecules
- New solution decomposition and minimization schemes for Poisson-Boltzmann equation in calculation of biomolecular electrostatics
- An effective minimization protocol for solving a size-modified Poisson-Boltzmann equation for biomolecule in ionic solvent
Cites work
- scientific article; zbMATH DE number 5669486 (Why is no real title available?)
- scientific article; zbMATH DE number 3933858 (Why is no real title available?)
- scientific article; zbMATH DE number 3459377 (Why is no real title available?)
- scientific article; zbMATH DE number 1022519 (Why is no real title available?)
- A finite element method for interface problems in domains with smooth boundaries and interfaces
- A new minimization protocol for solving nonlinear Poisson-Boltzmann mortar finite element equation
- A nonlinear elasticity model of macromolecular conformational change induced by electrostatic forces
- Accurate evaluation of electrostatics for macromolecules in solution
- Continuum solvation model: Computation of electrostatic forces from numerical solutions to the Poisson-Boltzmann equation
- Finite element methods and their convergence for elliptic and parabolic interface problems
- Minimization of Electrostatic Free Energy and the Poisson–Boltzmann Equation for Molecular Solvation with Implicit Solvent
- New solution decomposition and minimization schemes for Poisson-Boltzmann equation in calculation of biomolecular electrostatics
- Regularity results for elliptic equations in Lipschitz domains
- The Finite Element Approximation of the Nonlinear Poisson–Boltzmann Equation
- The Mathematical Theory of Finite Element Methods
- The immersed boundary method
Cited in
(39)- A new block preconditioner and improved finite element solver of Poisson-Nernst-Planck equation
- A Poisson-Boltzmann equation test model for protein in spherical solute region and its applications
- A simple and efficient technique to accelerate the computation of a nonlocal dielectric model for electrostatics of biomolecule
- Some new fractional integral inequalities for exponentially \(m\)-convex functions via extended generalized Mittag-Leffler function
- On the analysis and application of an ion size-modified Poisson-Boltzmann equation
- On Pólya-Szegö and Čebyšev type inequalities via generalized \(k\)-fractional integrals
- Association of Jensen's inequality for \(s\)-convex function with Csiszár divergence
- Sharp rational bounds for the gamma function
- Petrović-type inequalities for harmonic \(h\)-convex functions
- A flux-jump preserved gradient recovery technique for accurately predicting the electrostatic field of an immersed biomolecule
- Modeling and computation of heterogeneous implicit solvent and its applications for biomolecules
- Sharp bounds for Neuman means in terms of two-parameter contraharmonic and arithmetic mean
- SDPBS web server for calculation of electrostatics of ionic solvated biomolecules
- Delay dynamic double integral inequalities on time scales with applications
- New solution decomposition and minimization schemes for Poisson-Boltzmann equation in calculation of biomolecular electrostatics
- A super-Gaussian Poisson-Boltzmann model for electrostatic free energy calculation: smooth dielectric distribution for protein cavities and in both water and vacuum states
- Some new inequalities involving \(\kappa \)-fractional integral for certain classes of functions and their applications
- Notes on the complete elliptic integral of the first kind
- New generalized Pólya-Szegö and Čebyšev type inequalities with general kernel and measure
- Inequalities involving conformable approach for exponentially convex functions and their applications
- A new finite element and finite difference hybrid method for computing electrostatics of ionic solvated biomolecule
- Inequalities for generalized trigonometric and hyperbolic functions with one parameter
- A nonlocal modified Poisson-Boltzmann equation and finite element solver for computing electrostatics of biomolecules
- Modeling and computation of heterogeneous implicit solvent and its applications for biomolecules
- A note on generalized convex functions
- Hermite-Hadamard type inequalities for co-ordinated convex and qausi-convex functions and their applications
- New Hermite-Hadamard type inequalities for \(n\)-polynomial harmonically convex functions
- On Grüss inequalities within generalized \(\mathcal{K}\)-fractional integrals
- Optimal two-parameter geometric and arithmetic mean bounds for the Sándor-Yang mean
- Sharp one-parameter geometric and quadratic means bounds for the Sándor-Yang means
- Mathematical study of non-ideal electrostatic correlations in equilibrium electrolytes
- Finite volume element method for predicting electrostatics of a biomolecule immersed in an ionic solvent
- New estimates of \(q_1 q_2\)-Ostrowski-type inequalities within a class of \(n\)-polynomial prevexity of functions
- On new modifications governed by quantum Hahn's integral operator pertaining to fractional calculus
- Some new Hermite-Hadamard-type inequalities associated with conformable fractional integrals and their applications
- Minimization of Electrostatic Free Energy and the Poisson–Boltzmann Equation for Molecular Solvation with Implicit Solvent
- scientific article; zbMATH DE number 5669484 (Why is no real title available?)
- Physics-guided multiple regression analysis for calculating electrostatic free energies of proteins in different reference states
- Calculation of electrostatic free energy for the nonlinear Poisson-Boltzmann model based on the dimensionless potential
This page was built for publication: A new analysis of electrostatic free energy minimization and Poisson-Boltzmann equation for protein in ionic solvent
Report a bug (only for logged in users!)Click here to report a bug for this page (MaRDI item Q457589)
