Bayesian statistical analysis of protein side‐chain rotamer preferences

Numerical recipes in C

1994 • 15,831 citations

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

1983 • 14,615 citations

Bayesian Data Analysis

1995 • 14,293 citations

Comparative Protein Modelling by Satisfaction of Spatial Restraints

1993 • 12,640 citations

Principles of protein folding — A perspective from simple exact models

1995 • 1,532 citations

Tertiary templates for proteins

1987 • 1,485 citations

Calculation of conformational ensembles from potentials of mena force

1990 • 1,091 citations

Molecular diversity of arbuscular mycorrhizal fungi colonising arable crops

2001 • 920 citations

Backbone-dependent Rotamer Library for Proteins Application to Side-chain Prediction

1993 • 910 citations

Comparative protein modeling by satisfaction of spatial restraints

1995 • 785 citations

Conformation of amino acid side-chains in proteins

1978 • 777 citations

Prediction of protein side-chain rotamers from a backbone-dependent rotamer library: a new homology modeling tool

1997 • 565 citations

Accurate modeling of protein conformation by automatic segment matching

1992 • 558 citations

Analysis of the relationship between side-chain conformation and secondary structure in globular proteins

1987 • 422 citations

Structure and refinement of penicillopepsin at 1.8 Å resolution

1983 • 405 citations

A New Approach to the Rapid Determination of Protein Side Chain Conformations

1991 • 345 citations

Conformational analysis of the backbone-dependent rotamer preferences of protein sidechains

1994 • 342 citations

Side-chain torsional potentials: effect of dipeptide, protein, and solvent environment

1979 • 294 citations

Theory of cooperative transitions in protein molecules. I. Why denaturation of globular protein is a first‐order phase transition

1989 • 288 citations

The Vibration Frequencies and Thermodynamic Functions of Long Chain Hydrocarbons

1940 • 287 citations

Influence of local interactions on protein structure. I. Conformational energy studies of N‐acetyl‐N′‐methylamides of pro‐X and X‐pro dipeptides

1977 • 266 citations

An algorithm for determining the conformation of polypeptide segments in proteins by systematic search

1986 • 261 citations

Statistical and energetic analysis of side‐chain conformations in oligopeptides

1983 • 238 citations

Knowledge based modelling of homologous proteins, part II: rules for the conformations of substituted sidechains

1987 • 233 citations

Rotamers: To be or not to be?

1993 • 223 citations

Improving the quality of NMR and crystallographic protein structures by means of a conformational database potential derived from structure databases

1996 • 210 citations

Molecular Orbital Calculations on the Conformation of Amino Acid Residues of Proteins

1974 • 179 citations

AN ANALYSIS OF SIDE‐CHAIN CONFORMATION IN PROTEINS*

1979 • 159 citations

Rotational barriers. 2. Energies of alkane rotamers. An examination of gauche interactions

1988 • 155 citations

Energy Parameters in Polypeptides. VI. Conformational Energy Analysis of the N‐Acetyl N′‐Methyl Amides of the Twenty Naturally Occurring Amino Acids

1973 • 148 citations

The use of position‐specific rotamers in model building by homology

1995 • 146 citations

STUDIES ON THE CONFORMATION OF AMINO ACIDS

1971 • 143 citations

Side‐chain entropy and packing in proteins

1994 • 142 citations

The Entropy of Ethane and the Third Law of Thermodynamics. Hindered Rotation of Methyl Groups

1937 • 125 citations

Low-frequency Raman spectrum and asymmetric potential function for internal rotation of gaseous n-butane

1980 • 106 citations

Chemical Equilibria, Free Energies, and Heat Contents for Gaseous Hydrocarbons.

1940 • 91 citations

Analysis of torsional spectra of molecules with two internal C3v rotors. 12. Low frequency vibrational spectra, methyl torsional potential function, and internal rotation of n-butane

1979 • 85 citations

STUDIES ON THE CONFORMATION OF AMINO ACIDS

1970 • 75 citations

An Approach to the Internal Rotation Problem

1963 • 54 citations

Studies on the conformation of amino acids. IX. Conformations of butyl, seryl, threonyl, cysteinyl, and valyl residues in a dipeptide unit

1971 • 53 citations

Studies on the conformation of amino acids X. Conformations of norvalyl, leucyl and aromatic side groups in a dipeptide unit

1971 • 42 citations

OBSTRUCT: a program to obtain largest cliques from a protein sequence set according to structural resolution and sequence similarity

1992 • 42 citations

CONFORMATIONAL ANALYSIS OF AROMATIC AMINO ACIDS BY X‐RAY CRYSTALLOGRAPHY

1973 • 33 citations

Influence of local interactions on protein structure. IV. Conformational energy studies of N‐acetyl‐N′‐mehylamides of Ser‐X‐ and X‐Ser dipeptides

1978 • 23 citations

A statistical analysis of side-chain conformations in proteins: Comparison with ECEPP predictions

1994 • 12 citations

Comparing theoretical and experimental backbone-dependent sidechain conformational preferences for linear, branched, aromatic and polar residues

1996 • 7 citations