Hybrid Monte Carlo with multidimensional replica exchanges: Conformational equilibria of the hypervariable regions of a llama VHH antibody domain

Biopolymers

Volumn 68, Issue 2, 2003, Pages 160-177

  Fenwick, Michael K ^a   Escobedo, Fernando A ^a  

^a Department of Obstetrics Gynecology   (United States)

Author keywords

Camelid antibodies; Canonical structure model; Generalized ensemble methods; Hypervariable regions; Replica exchange

Indexed keywords

COMPUTER SIMULATION; CONFORMATIONS; CRYSTAL STRUCTURE; MOLECULAR DYNAMICS; MONTE CARLO METHODS;

CANONICAL STRUCTURES;

ANTIBODIES;

ANTIBODY; ANTIGEN;

ANTIGEN BINDING; ARTICLE; ARTIODACTYLA; CONFORMATION; EQUILIBRIUM CONSTANT; HAMILTON SCALE; HISTOLOGY; HYPOTHESIS; MOLECULAR BIOLOGY; MOLECULAR DYNAMICS; MONTE CARLO METHOD; SAMPLING; TEMPERATURE;

AMINO ACID SEQUENCE; ANIMALS; CAMELIDS, NEW WORLD; COMPUTER SIMULATION; CRYSTALLIZATION; HUMANS; IMMUNOGLOBULIN HEAVY CHAINS; IMMUNOGLOBULIN VARIABLE REGION; MODELS, ANIMAL; MODELS, MOLECULAR; MONTE CARLO METHOD; PEPTIDE FRAGMENTS; PROTEIN CONFORMATION; PROTEIN FOLDING; PROTEIN STRUCTURE, SECONDARY;

CAMELIDAE; LAMA GLAMA;

EID: 0037322915     PISSN: 00063525     EISSN: None     Source Type: Journal    
DOI: 10.1002/bip.10291     Document Type: Article

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