Boundary element solution of macromolecular electrostatics: interaction energy between two proteins
about
Electrostatics of nanosystems: application to microtubules and the ribosomeBiomolecular electrostatics and solvation: a computational perspectiveComputation of electrostatic forces between solvated molecules determined by the Poisson-Boltzmann equation using a boundary element methodA biomolecular electrostatics solver using Python, GPUs and boundary elements that can handle solvent-filled cavities and Stern layersPolarizability and Kerr constant of proteins by boundary element methods.Progress in developing Poisson-Boltzmann equation solvers.Computation of molecular electrostatics with boundary element methods.Molecular origins of osmotic second virial coefficients of proteins.Sampling field heterogeneity at the heme of c-type cytochromes by spectral hole burning spectroscopy and electrostatic calculationsExploring a charge-central strategy in the solution of Poisson's equation for biomolecular applicationsExploring a coarse-grained distributive strategy for finite-difference Poisson-Boltzmann calculations.A Fast and Robust Poisson-Boltzmann Solver Based on Adaptive Cartesian Grids.Order N algorithm for computation of electrostatic interactions in biomolecular systemsAccurate solution of multi-region continuum biomolecule electrostatic problems using the linearized Poisson-Boltzmann equation with curved boundary elements.A "Reverse-Schur" Approach to Optimization With Linear PDE Constraints: Application to Biomolecule Analysis and DesignAcceleration of Linear Finite-Difference Poisson-Boltzmann Methods on Graphics Processing Units.Calculation of translational friction and intrinsic viscosity. II. Application to globular proteinsA new FFT-based algorithm to compute Born radii in the generalized Born theory of biomolecule solvationRecent advances in macromolecular hydrodynamic modeling.Fast Analytical Methods for Macroscopic Electrostatic Models in Biomolecular Simulations.A revised density function for molecular surface definition in continuum solvent models.Calculating protein-ligand binding affinities with MMPBSA: Method and error analysis.Modeling the electrophoresis of rigid polyions: application to lysozyme.Mathematical analysis of the boundary-integral based electrostatics estimation approximation for molecular solvation: exact results for spherical inclusions.Assessment of linear finite-difference Poisson-Boltzmann solversExploring accurate Poisson-Boltzmann methods for biomolecular simulations.AN EFFICIENT HIGHER-ORDER FAST MULTIPOLE BOUNDARY ELEMENT SOLUTION FOR POISSON-BOLTZMANN BASED MOLECULAR ELECTROSTATICS.Reducing grid-dependence in finite-difference Poisson-Boltzmann calculations.Dielectric pressure in continuum electrostatic solvation of biomolecules.Protein-protein diffusional encounter.Modeling Membrane Protein-Ligand Binding Interactions: The Human Purinergic Platelet Receptor.Charge Central Interpretation of the Full Nonlinear PB Equation: Implications for Accurate and Scalable Modeling of Solvation Interactions.A "parallel plate" electrostatic model for bimolecular rate constants applied to electron transfer proteins.A New and Efficient Poisson-Boltzmann Solver for Interaction of Multiple Proteins.Calculation of translational friction and intrinsic viscosity. I. General formulation for arbitrarily shaped particles.Electrostatic forces in the Poisson-Boltzmann systems.Applications of MMPBSA to Membrane Proteins I: Efficient Numerical Solutions of Periodic Poisson-Boltzmann Equation.Using Correlated Monte Carlo Sampling for Efficiently Solving the Linearized Poisson-Boltzmann Equation Over a Broad Range of Salt Concentration.Enhancement of protein-protein association rate by interaction potential: accuracy of prediction based on local Boltzmann factor.On removal of charge singularity in Poisson-Boltzmann equation.
P2860
Q24555224-41C5E5D0-3D97-45CF-8100-0A20C97C75B2Q26853115-B8F7F716-7039-421E-99D3-3222801A1A59Q28258051-24661538-10B2-49BA-A4A8-FCE85C05840DQ28655258-EB03F229-6036-493C-B539-E52F43755EB5Q30359221-469273CD-85AD-4A3C-8135-1C4981C88F00Q30447589-416DC12F-A407-42A8-B3FA-EE0C46F26685Q33907541-C9F7F47A-E43C-424E-A0DE-091FF7B02291Q34169400-71BB8542-EC25-4B8A-8D00-9C15C6649C7BQ34172050-66220A2A-E86F-4134-9A8F-06EA85E6FBB6Q34475317-70414BE6-6F7A-482D-9A74-6356CAAD91ADQ35127184-7B5A7BB4-0705-4B4D-B625-7AF4756DE06AQ35282654-82493FFE-BD5A-44AA-BF6E-AF81CC68F5E9Q35539942-A37D492B-3A21-4CB7-9D4E-87EEA8A84003Q36301793-59BF64F8-1075-4802-A5EC-E39A2216CA8FQ36301813-A3A62071-0B8C-4C6B-9B03-E9FE948E159CQ36384034-85DA66E9-ABF2-41BB-807F-6D32716F5585Q36795615-7177E6C3-2919-43CD-8EBD-D20D54F47285Q37006503-CE272483-FBD9-448D-B093-9C9F9CB2BA6AQ37809139-2598533F-CF15-4941-AF6F-0D72E0004C68Q38112677-0F19DFA5-B361-460D-BCB6-42F127EAA9D0Q38657719-22B65037-4D60-43F7-AA71-6F2E3C06001EQ39502838-D587B801-BE1B-4007-848B-2043268A7C85Q39661671-DE9F6D8A-A1EE-4DDF-BDE0-40F022DF5FE8Q39700698-3E7DA858-3D01-4D1F-9812-D8F41273B029Q39910956-D75ECDEC-CEE2-4D70-B9F6-22B6DB16378EQ41871254-D5DD986F-7112-41D9-8F37-EA0F3CA2F632Q41904618-96E4BD38-DE2C-4D60-9676-EA700A8AC85CQ41908438-1F1112FB-3167-4864-839C-97B96D32FD3FQ42014245-57E8C61D-33D6-4BCC-BB82-F00363E01C66Q42037225-4A2ACB5B-5C79-41BC-9676-06268B0097E1Q42079428-162CE8C0-7CEE-45EE-9BBA-994B2D00B012Q42109984-F855E70B-B65A-4562-ABC4-F419D61E51D4Q42186958-D1829C30-E421-45AE-80A2-65D3B92313E3Q42539878-DA9BF9AC-E4A2-4BE8-81FF-DD937A4A157EQ42541276-CFC63734-7116-44D6-B527-3ECAC310326EQ42647125-8AD4542D-B66B-40B0-A129-3078883AB742Q42688030-725BC0F4-32A4-40A8-AE40-2BEA469CEA5EQ42733039-96BA43CB-416A-4C28-8002-AC82BAA97B5EQ42929140-0039818F-1B3D-4A02-A861-C9E031C99400Q45972522-5B8B5DE3-F651-44E9-9C04-B1ED3CB6D937
P2860
Boundary element solution of macromolecular electrostatics: interaction energy between two proteins
description
1993 nî lūn-bûn
@nan
1993 թուականի Օգոստոսին հրատարակուած գիտական յօդուած
@hyw
1993 թվականի օգոստոսին հրատարակված գիտական հոդված
@hy
1993年の論文
@ja
1993年論文
@yue
1993年論文
@zh-hant
1993年論文
@zh-hk
1993年論文
@zh-mo
1993年論文
@zh-tw
1993年论文
@wuu
name
Boundary element solution of m ...... on energy between two proteins
@ast
Boundary element solution of m ...... on energy between two proteins
@en
Boundary element solution of m ...... on energy between two proteins
@nl
type
label
Boundary element solution of m ...... on energy between two proteins
@ast
Boundary element solution of m ...... on energy between two proteins
@en
Boundary element solution of m ...... on energy between two proteins
@nl
prefLabel
Boundary element solution of m ...... on energy between two proteins
@ast
Boundary element solution of m ...... on energy between two proteins
@en
Boundary element solution of m ...... on energy between two proteins
@nl
P2860
P1433
P1476
Boundary element solution of m ...... on energy between two proteins
@en
P2093
P2860
P304
P356
10.1016/S0006-3495(93)81094-4
P407
P577
1993-08-01T00:00:00Z