Refolding simulations of an isolated fragment of barnase into a native-like β hairpin: Evidence for compactness and hydrogen bonding as concurrent stabilizing factors

Numerical integration of the cartesian equations of motion of a system with constraints: molecular dynamics of n-alkanes

1977 • 19,896 citations

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

1983 • 14,802 citations

<scp>CHARMM</scp>: A program for macromolecular energy, minimization, and dynamics calculations

1983 • 14,615 citations

MOLSCRIPT: a program to produce both detailed and schematic plots of protein structures

1991 • 14,222 citations

INTERMEDIATES IN THE FOLDING REACTIONS OF SMALL PROTEINS

1990 • 1,133 citations

Measurement of the β-sheet-forming propensities of amino acids

1994 • 584 citations

Fast Events in Protein Folding: Helix Melting and Formation in a Small Peptide

1996 • 555 citations

Protein folding: Hypotheses and experiments

1987 • 544 citations

Defining Solution Conformations of Small Linear Peptides

1991 • 528 citations

A short linear peptide that folds into a native stable β-hairpin in aqueous solution

1994 • 516 citations

Gene duplications in the structural evolution of chymotrypsin

1979 • 501 citations

Cooperativity in protein-folding kinetics.

1993 • 470 citations

Folding of immunogenic peptide fragments of proteins in water solution

1988 • 437 citations

PATHWAYS OF PROTEIN FOLDING

1993 • 435 citations

β-Turns and their distortions: a proposed new nomenclature

1990 • 393 citations

Folding of peptide fragments comprising the complete sequence of proteins

1992 • 391 citations

A Thermodynamic Scale for the .beta.-Sheet Forming Tendencies of the Amino Acids

1994 • 391 citations

Thermodynamic β -sheet propensities measured using a zinc-finger host peptide

1993 • 348 citations

Origins of structure in globular proteins.

1990 • 336 citations

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

1996 • 317 citations

De novo design and structural analysis of a model β-hairpin peptide system

1996 • 273 citations

The immunodominant site of a synthetic immunogen has a conformational preference in water for a type-II reverse turn

1985 • 225 citations

Molecular structure of a new family of ribonucleases

1982 • 222 citations

Histidine-aromatic interactions in barnase

1992 • 210 citations

NMR evidence of a short linear peptide that folds into a .beta.-hairpin in aqueous solution

1993 • 196 citations

The effects of internal constraints on the configurations of chain molecules

1990 • 194 citations

Ultrafast thermally induced unfolding of RNase A.

1995 • 182 citations

The folding of an enzyme

1992 • 172 citations

NMR Solution Structure of the Isolated N-Terminal Fragment of Protein-G B1 Domain. Evidence of Trifluoroethanol Induced Native-Like .beta.-Hairpin Formation

1994 • 168 citations

A short linear peptide derived from the N-terminal sequence of ubiquitin folds into a water-stable non-native β-hairpin

1995 • 164 citations

Free Energy Determinants of Secondary Structure Formation: II. Antiparallel β-Sheets

1995 • 160 citations

Direct NMR evidence for an intermediate preceding the rate-limiting step in the unfolding of ribonuclease A

1995 • 152 citations

Kinetics of Folding of the All-β Sheet Protein Interleukin-1β

1993 • 148 citations

A Comparison of the pH, Urea, and Temperature-denatured States of Barnase by Heteronuclear NMR: Implications for the Initiation of Protein Folding

1995 • 130 citations

Importance of Two Buried Salt Bridges in the Stability and Folding Pathway of Barnase

1996 • 124 citations

Automatic Classification and Analysis of αα-Turn Motifs in Proteins

1996 • 119 citations

Dissecting the Structure of a Partially Folded Protein

1993 • 119 citations

Protein folding

1991 • 95 citations

Transfer of a β-turn structure to a new protein context

1989 • 92 citations

Conformational investigation of designed short linear peptides able to fold into β-hairpin structures in aqueous solution

1996 • 91 citations

Adding backbone to protein folding: why proteins are polypeptides

1996 • 88 citations

Kinetic and equilibrium intermediates in protein folding

1994 • 87 citations

Native-like β-hairpin structure in an isolated fragment from ferredoxin: NMR and CD studies of solvent effects on the N-terminal 20 residues

1996 • 73 citations

The Origins of Protein Secondary Structure

1994 • 56 citations

Interactions Contributing to the Formation of a β-Hairpin-like Structure in a Small Peptide

1996 • 55 citations

Determination of the conformation of folding initiation sites in proteins by computer simulation

1995 • 46 citations

Are turns required for the folding of ribonuclease T1?

1996 • 31 citations

An NMR study on the β-hairpin region of barnase

1996 • 23 citations

Unfolding Simulations of the 85-102 β-Hairpin of Barnase

1995 • 18 citations