All-atom generalized-ensemble simulations of small proteins

Journal of Molecular Graphics and Modelling

Volumn 22, Issue 5, 2004, Pages 397-403

  Kinnear, Brian S ^a   Jarrold, Martin F ^b   Hansmann, Ulrich H E ^c  

^a INTEL CORPORATION   (United States)

^b INDIANA UNIVERSITY   (United States)

^c MICHIGAN TECHNOLOGICAL UNIVERSITY   (United States)

Author keywords

Generalized ensemble simulations; HP 36; Proteins

Indexed keywords

AMINO ACIDS; COMPUTER SIMULATION; CRYSTAL ATOMIC STRUCTURE; POLYPEPTIDES; PROTEINS;

ALL-ATOM SIMULATIONS; PEPTIDES;

MOLECULAR DYNAMICS;

ALANINE; AMINO ACID; PROTEIN;

ACCURACY; ALGORITHM; ATOM; CONFERENCE PAPER; ENERGY; MATHEMATICAL COMPUTING; MOLECULAR DYNAMICS; MOLECULAR MODEL; PREDICTION; PRIORITY JOURNAL; PROTEIN DOMAIN; PROTEIN FOLDING; PROTEIN STRUCTURE; SIMULATION;

COMPUTER SIMULATION; MODELS, MOLECULAR; NEUROFILAMENT PROTEINS; PEPTIDE FRAGMENTS; PEPTIDES; PROTEIN STRUCTURE, SECONDARY; PROTEIN STRUCTURE, TERTIARY; PROTEINS; TEMPERATURE;

EID: 1942455290     PISSN: 10933263     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jmgm.2003.12.006     Document Type: Conference Paper

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