Absolute comparison of simulated and experimental protein-folding dynamics

Dictionary of protein secondary structure: Pattern recognition of hydrogen‐bonded and geometrical features

1983 • 14,802 citations

The OPLS [optimized potentials for liquid simulations] potential functions for proteins, energy minimizations for crystals of cyclic peptides and crambin

1988 • 4,676 citations

A Rapidly Convergent Descent Method for Minimization

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Rattle: A “velocity” version of the shake algorithm for molecular dynamics calculations

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From Levinthal to pathways to funnels

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CHROMATOGRAPHY OF AMINO ACIDS ON SULFONATED POLYSTYRENE RESINS

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Contact order, transition state placement and the refolding rates of single domain proteins 1 1Edited by P. E. Wright

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Statistical mechanics of isomerization dynamics in liquids and the transition state approximation

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Pathways to a Protein Folding Intermediate Observed in a 1-Microsecond Simulation in Aqueous Solution

1998 • 1,336 citations

Navigating the Folding Routes

1995 • 1,193 citations

The GB/SA Continuum Model for Solvation. A Fast Analytical Method for the Calculation of Approximate Born Radii

1997 • 945 citations

The folding of an enzyme

1992 • 931 citations

An efficient newton‐like method for molecular mechanics energy minimization of large molecules

1987 • 865 citations

Screen Savers of the World Unite!

2000 • 558 citations

F<scp>ROM</scp> F<scp>OLDING</scp> T<scp>HEORIES TO</scp> F<scp>OLDING</scp> P<scp>ROTEINS</scp>: A Review and Assessment of Simulation Studies of Protein Folding and Unfolding

2001 • 472 citations

Measuring the rate of intramolecular contact formation in polypeptides

2000 • 406 citations

Reversible peptide folding in solution by molecular dynamics simulation 1 1Edited by R. Huber

1998 • 374 citations

Application of a Self-consistent Mean Field Theory to Predict Protein Side-chains Conformation and Estimate Their Conformational Entropy

1994 • 355 citations

The speed limit for protein folding measured by triplet–triplet energy transfer

1999 • 353 citations

Direct observation of fast protein folding: the initial collapse of apomyoglobin.

1996 • 317 citations

Protein folding and unfolding in microseconds to nanoseconds by experiment and simulation

2000 • 310 citations

Design of a Monomeric 23-Residue Polypeptide with Defined Tertiary Structure

1996 • 299 citations

β-hairpin folding simulations in atomistic detail using an implicit solvent model 1 1Edited by F. Cohen

2001 • 273 citations

Fast events in protein folding: Relaxation dynamics of secondary and tertiary structure in native apomyoglobin

1997 • 211 citations

Folding simulations of a three-stranded antiparallel β-sheet peptide

2000 • 175 citations

Kinetics and Dynamics of Loops, α-Helices, β-Hairpins, and Fast-Folding Proteins

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Amino acid determination : methods and techniques

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Thermodynamics and Kinetics of Folding of Two Model Peptides Investigated by Molecular Dynamics Simulations

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Design and NMR analyses of compact, independently folded BBA motifs

1998 • 77 citations

Submicrosecond real-time fluorescence sampling: application to protein folding

2000 • 55 citations