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Citing Papers
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A generalized fast multipole approach for Hartree—Fock and density functional computations
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The role of long range forces in ordered arrays of tobacco mosaic virus
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An examination of the five-site potential (TIP5P) for water
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Construction of Porous Solids from Hydrogen-Bonded Metal Complexes of 1,3,5-Benzenetricarboxylic Acid
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Monte Carlo studies of the dipolar spin ice model
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An algorithm for the simulation of condensed matter which grows as the 3/2 power of the number of particles
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Optical Trapping and Manipulation of Viruses and Bacteria
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Improved patch-clamp techniques for high-resolution current recording from cells and cell-free membrane patches
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Consistent dielectric properties of the simple point charge and extended simple point charge water models at 277 and 300 K
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The multiscale coarse-graining method. II. Numerical implementation for coarse-grained molecular models
2008
A comprehensive study of the phase diagram of symmetrical hard-core Yukawa mixtures
1998
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On the use of the Ewald summation in computer simulation
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Functional theory of extended Coulomb systems
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An Ewald summation method for planar surfaces and interfaces
1992
Ewald summation for systems with slab geometry
1999
Structures and Properties of Self-Assembled Monolayers of Bistable [2]Rotaxanes on Au (111) Surfaces from Molecular Dynamics Simulations Validated with Experiment
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Experimental Evidence for Surface Roughening in Two Dimensions
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Computer simulations of NaCl association in polarizable water
1994
Hydrogen-bond kinetics in liquid water
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Surface tension of water and acid gases from Monte Carlo simulations
2008
Reaction field, screening, and long-range interactions in simulations of ionic and dipolar systems
1994
Quantum Monte Carlo simulations of solids
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Scanning tunneling microscopy of the local atomic structure of two-dimensional gold and silver islands on graphite
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The role of long ranged forces in determining the structure and properties of liquid water
1983
Signature of magnetic monopole and Dirac string dynamics in spin ice
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On the calculation of the dielectric constant using the Ewald-Kornfeld tensor
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Influence of Dipolar Interaction on Magnetic Properties of Ultrafine Ferromagnetic Particles
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Canonical sampling through velocity rescaling
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1984
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1997
Structure and mechanism of the reversible photoswitch of a fluorescent protein
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Quantification of the hydrophobic interaction by simulations of the aggregation of small hydrophobic solutes in water
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1998
Free Energy of Ionic Hydration
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Effective pair potentials and the properties of water
1989
Ultrahigh-Density Nanowire Arrays Grown in Self-Assembled Diblock Copolymer Templates
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Effect of the treatment of long-range forces on the dynamics of ions in aqueous solutions
1995
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1996
Quantum Mechanical Continuum Solvation Models
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Molecular simulation of the solubility of carbon dioxide in aqueous solutions of sodium chloride
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Fast Parallel Algorithms for Short-Range Molecular Dynamics
1995 Standout
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The fast Fourier Poisson method for calculating Ewald sums
1994
Computer simulation of ionic systems: The distorting effects of the boundary conditions
1979
Performance of fast multipole methods for calculating electrostatic interactions in biomacromolecular simulations
1994
Development of an improved four-site water model for biomolecular simulations: TIP4P-Ew
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Finite-size errors in quantum many-body simulations of extended systems
1999
Influence of Artificial Periodicity and Ionic Strength in Molecular Dynamics Simulations of Charged Biomolecules Employing Lattice-Sum Methods
2003
Error estimates on averages of correlated data
1989
2.1 and 1.8 Å Average Cα RMSD Structure Predictions on Two Small Proteins, HP-36 and S15
2001 StandoutNobel
Linear scaling computation of the Fock matrix
1997
Hybrid functionals based on a screened Coulomb potential
2003 Standout
Computer Simulation of Molecular Dynamics: Methodology, Applications, and Perspectives in Chemistry
1990
On the forces between phospholipid bilayers
1978
Accuracy and efficiency of the particle mesh Ewald method
1995
Molecular-dynamics simulations of Coulombic systems on distributed-memory MIMD machines
1993
A smooth particle mesh Ewald method
1995 Standout
Works of E.R. Smith being referenced
Simulation of electrostatic systems in periodic boundary conditions. I. Lattice sums and dielectric constants
1980
Simulation of electrostatic systems in periodic boundary conditions. III. Further theory and applications
1983
Electrostatic energy in ionic crystals
1981
Simulation of electrostatic systems in periodic boundary conditions. II. Equivalence of boundary conditions
1980
Error estimates for the fast multipole method. I. The two-dimensional case
1995
Monte Carlo simulation of a planar Ising model roughening transition
1981
Microscopic derivation of fluctuation formulas for calculating dielectric constants by simulation
1987
Perturbation theory for the dielectric constant
1981
On the interdependence of van der waals and double layer forces
1973
Boundary conditions on hydrodynamics in simulations of dense suspensions
1987
Effects of periodic boundary conditions on simulations of ionic systems
1980
ALD of SiO[sub 2] at Room Temperature Using TEOS and H[sub 2]O with NH[sub 3] as the Catalyst
2004
Surface-film thickening: An exactly solvable model
1982
Deviations of the van der waals energy for two interacting spheres from the predictions of Hamaker theory
1973
Inconsistency of the density-functional theory of adsorption when using computer simulations
1979
Hydrodynamic interactions in Brownian dynamics
1987
Dielectric constants from computer simulations
1987
Simulation of two dimensional systems with two dimensional electrostatics
1982
On the Yukawa closure of the Ornstein-Zernike equation
1979
The dipole-dipole potential in statistical mechanics
1975
Thermodynamic limit for classical systems with Coulomb interactions in a constant external field
1972
Computer Simulation of the Static Dielectric Constant of Systems with Permanent Electric Dipoles
1986
Liquid—gas transition for hard spheres with attractive Yukawa tail interactions
1979
The very fast multipole method
1994
Calculating the pressure in simulations using periodic boundary conditions
1994
Electrostatic potential at an ionic crystal surface
1986