Torsion angle dynamics: Reduced variable conformational sampling enhances crystallographic structure refinement

Proteins: Structure, Function, and Bioinformatics

Volumn 19, Issue 4, 1994, Pages 277-290

  Rice, Luke M ^a   BrüNger, Axel T ^a  

^a YALE UNIVERSITY   (United States)

Author keywords

conformational sampling; molecular dynamics; refinement; simulated annealing; torsion angle dynamics; X ray crystallography

Indexed keywords

ALGORITHM; ARTICLE; CRYSTAL STRUCTURE; MOLECULAR DYNAMICS; PRIORITY JOURNAL; PROTEIN CONFORMATION; STRUCTURE ANALYSIS; X RAY CRYSTALLOGRAPHY;

ALGORITHMS; COMPUTER SIMULATION; CRYSTALLOGRAPHY, X-RAY; MODELS, CHEMICAL; MODELS, MOLECULAR; MOLECULAR CONFORMATION; MOTION; SUPPORT, U.S. GOV'T, NON-P.H.S.;

EID: 0028070557     PISSN: 08873585     EISSN: 10970134     Source Type: Journal    
DOI: 10.1002/prot.340190403     Document Type: Article

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