Standout Papers
Citation Impact
Citing Papers
Recognizing Native Folds by the Arrangement of Hydrophobic and Polar Residues
1995 StandoutNobel
Inference of Macromolecular Assemblies from Crystalline State
2007 Standout
A method for predicting protein structure from sequence
1993
A Novel Method for Sampling Alpha-helical Protein Backbones
2001 StandoutNobel
From Structure to Sequence and Back Again
1996 StandoutNobel
Exploring conformational space with a simple lattice model for protein structure
1994 StandoutNobel
De novo protein design. I. in search of stability and specificity
1999 StandoutNobel
PDB-based protein loop prediction: parameters for selection and methods for optimization
1997 StandoutNobel
The complexity and accuracy of discrete state models of protein structure
1995 StandoutNobel
Rapid refinement of protein interfaces incorporating solvation: application to the docking problem
1998
Energy Functions that Discriminate X-ray and Near-native Folds from Well-constructed Decoys
1996 StandoutNobel
Protein–Protein Docking with Simultaneous Optimization of Rigid-body Displacement and Side-chain Conformations
2003 StandoutNobel
Small Libraries of Protein Fragments Model Native Protein Structures Accurately
2002 StandoutNobel
Probing Protein Fold Space with a Simplified Model
2007 StandoutNobel
Hybrid porous solids: past, present, future
2007 Standout
Ground State of LiquidHe 4
1965
PROTEIN FOLDING: The Endgame
1997 StandoutNobel
Surface structure of simple fluids
1972
Calculation of Matrix Elements for One-Dimensional Quantum-Mechanical Problems and the Application to Anharmonic Oscillators
1965
Low-density helium monolayers as two-dimensional imperfect gases: An analysis employing the second virial coefficient
1974
New alternative to the Dunham potential for diatomic molecules
1973
On the theory of the relaxation matrix and its application to microwave transient phenomena
1975 StandoutNobel
Computer Simulation of Liquids
2017 Standout
Pseudo-structures for the 20 common amino acids for use in studies of protein conformations by measurements of intramolecular proton-proton distance constraints with nuclear magnetic resonance
1983 StandoutNobel
On the hyper-chain equation of state of a hard-sphere gas
1963
Perturbation Theory and Equation of State for Fluids. II. A Successful Theory of Liquids
1967 Standout
The pair correlation function and thermodynamic properties for the Lennard-Jones 6–12 potential and the Percus-Yevick equation
1966
Hydrogen–atom scattering: Energy dependence of the total collision cross section for mercury
1975 StandoutNobel
Direct determination of phase coexistence properties of fluids by Monte Carlo simulation in a new ensemble
2002 Standout
High-Temperature Transport Properties of Alkali Metal Vapors
1965
Three-Particle Effects in the Pair Distribution Function forHe 4
1968
Quantum Corrections to the Equation of State for Nonanalytic Potentials
1972
Dimensional interpolation for two-electron atoms
1986 StandoutNobel
Quantum Corrections to the Coexistence Curve of Neon near the Triple Point
1969
A simplified representation of protein conformations for rapid simulation of protein folding
1976 StandoutNobel
What is "liquid"? Understanding the states of matter
1976 Standout
Generalized discrete variable approximation in quantum mechanics
1985 Standout
Scattering of anyons with hard-disk repulsion and the second virial coefficient
1991 StandoutNobel
Path-Integral Calculation of the Two-Particle Slater Sum forHe 4
1966
Molecular Beam Kinetics: Reactions of H and D Atoms with Diatomic Alkali Molecules
1971 StandoutNobel
Automatic identification of secondary structure in globular proteins
1977 StandoutNobel
Intermolecular Interactions: van der Waals Molecules
1972
Cross-correlation trajectory study of V–V energy transfer in HF–HF and DF–DF
1980 StandoutNobel
Funnel sculpting for in silico assembly of secondary structure elements of proteins
2003 StandoutNobel
Quantum-Mechanical Second Virial Coefficient of a Hard-Sphere Gas at High Temperature
1966
Reply to Comment on “Pattern formation by adsorbates with attractive lateral interactions”
1997 StandoutNobel
Harmonic oscillator integrals by operator methods, a simple unified approach
1996
Chemisorption and ordered surface structures
1964
An impact theory for Doppler and pressure broadening—I. General theory
1971
Distribution Function of Classical Fluids of Hard Spheres. I
1968
Mass-reduced quantum numbers: Application to the isotopic mercury hydrides
1975
A new interatomic potential function for helium
1968
Improved adsorption energetics within density-functional theory using revised Perdew-Burke-Ernzerhof functionals
1999 Standout
Monte Carlo grand canonical ensemble calculation in a gas-liquid transition region for 12-6 Argon
1975
Quantum-mechanical radial distribution function for a hard-sphere gas at low density and high temperature
1975
Perturbative three-body spectrum and the third virial coefficient in the anyon model
1991
The statistical mechanics of systems with steep intermolecular potentials
1964
In Vivo Half-Life of a Protein Is a Function of Its Amino-Terminal Residue
1986 StandoutScience
Method of Calculating Cross Sections for Molecular Collisions
1955
Quantum Corrections to the Second Virial Coefficient at High Temperatures
1968
Quasiclassical selection of initial coordinates and momenta for a rotating Morse oscillator
1975
Quantum third virial coefficient of a fractional-statistics gas
1992 StandoutNobel
Virial Coefficients and Models of Molecules in Gases. B
1955
Quantum theory of three-junction flux qubit with non-negligible loop inductance: Towards scalability
2006 StandoutNobel
Semiclassical theory of the effects of collisions between rotors on molecular spectral line shapes. I
1977 StandoutNobel
Molecular dynamics simulations at constant pressure and/or temperature
1980 Standout
Role of Repulsive Forces in Determining the Equilibrium Structure of Simple Liquids
1971 Standout
Quantum corrections to the properties of a dense fluid with non-analytic intermolecular potential function
1975
Quantum-Mechanical Second Virial Coefficient of a Hard-Sphere Gas at High Temperatures
1969
Quantum corrections to the properties of a dense fluid with non-analytic intermolecular potential function
1975
Ground State of Liquid Helium-4 and Helium-3
1967
Fourth Virial Coefficient for the Square-Well Potential. II
1966
Distribution Function of Classical Fluids of Hard Spheres. II
1971
Considerations on the Flow of Superfluid Helium
1966 StandoutNobel
Qualitative Aspects of the Quantum Mechanical Second Virial Coefficient
1971
A novel discrete variable representation for quantum mechanical reactive scattering via the S-matrix Kohn method
1992 Standout
Statistical mechanics of the packing of rods on a lattice: Cluster expansion for systematic corrections to mean field
1986 StandoutNobel
Folding and stability of helical proteins: Carp myogen
1976 StandoutNobel
Order–disorder phenomena in adsorbed layers described by a lattice gas model
1975 StandoutNobel
Isotope Effect of Superconductingα − Uranium
1968 StandoutNobel
Desorption and molecular interactions on surfaces: , and
1997
Vibrational–Translational Energy Transfer in the Near-Adiabatic Approximation
1970 StandoutNobel
On the quantum corrections to the radial distribution function and to the thermodynamic properties of fluids
1973
Protein folding by restrained energy minimization and molecular dynamics
1983 StandoutNobel
Nuclear magnetic resonance of labile protons in the basic pancreatic trypsin inhibitor
1979 StandoutNobel
Quantum-Mechanical Second Virial Coefficient of a Hard-Sphere Gas at High Temperatures
1967
On the theory of classical fluids II
1962
High-temperature exchange third virial coefficient for hard spheres via an asymptotic method for path integrals
1974
Quantum corrections to the radial distribution function of a fluid
1974
The Wigner distribution function in quantum statistics and the application to second virial coefficients
1964
The fluorescence excitation spectrum of the HeNO2 van der Waals complex
1977 StandoutNobel
Superconductivity ofα
1967
Low temperature expansions for the second and third cluster integrals of a two dimensional quantum system of hard discs
1983
Rotational and vibrational analysis of the ?←? system of XeF as observed in a supersonic free jet
1979 StandoutNobel
Quantum-Mechanical Second Virial Coefficient at High Temperatures
1970
A lattice model for protein structure prediction at low resolution.
1992 StandoutNobel
Lattice Models for Thermotropic Liquid Crystals
1976
Adsorption hysteresis in porous materials
1989
Prediction of protein antigenic determinants from amino acid sequences.
1981 Standout
Works of John E. Kilpatrick being referenced
Second Virial Coefficients of Helium from the Exp-Six Potential
1955
Second Virial Coefficients ofHe 3 He 4
1954
Statistical Mechanics
1956
Irreducible Cluster Integrals of Hard-Sphere Gases. II
1966
The Virial Equation of State: Its Inversion and Other Manipulations
1969
On the Quantum-Mechanical Pair-Correlation Function of 4He Gas at Low Temperatures
1966
Term Series for a Rotating-Vibrating Diatomic Molecule by Perturbation
1959
Exchange and Direct Second Virial Coefficients for Hard Spheres
1966
A Quantum-Mechanical Treatment of Virial Coefficients
1953
Negative Cluster Concentrations
1953
Quantum Mechanical Second Virial Coefficient of a Lennard-Jones Gas. Helium
1969
A set of hyperspherical harmonics especially suited for three-body collisions in a plane
1987
Suppression at High Temperature of Effects Due to Statistics in the Second Virial Coefficient of a Real Gas
1965
Superconductivity of Uranium
1955
Structure of the Xp Matrices in the Simple Harmonic Oscillator Representation
1965
Discrete Energy Levels Associated with the Lennard-Jones Potential
1951