Steered molecular dynamics simulations of ligand-receptor interaction in lipocalins

European Biophysics Journal

Volumn 40, Issue 2, 2011, Pages 181-194

  Kalikka, Janne ^a   Akola, Jaakko ^a,b  

^a UNIVERSITY OF JYVÄSKYLÄ   (Finland)

^b TAMPERE UNIVERSITY OF TECHNOLOGY   (Finland)

Author keywords

Digoxigenin; Ligand receptor interaction; Lipocalins; Molecular dynamics; Retinol binding protein; Steered molecular dynamics

Indexed keywords

DIGOXIGENIN; LIGAND; LIPOCALIN; PEPTIDE; RETINOL BINDING PROTEIN; SOLVENT; WATER;

ARTICLE; BINDING SITE; CHEMICAL PHENOMENA; CHEMISTRY; METABOLISM; MOLECULAR DYNAMICS; TIME;

BINDING SITES; DIGOXIGENIN; HYDROPHOBIC AND HYDROPHILIC INTERACTIONS; LIGANDS; LIPOCALINS; MOLECULAR DYNAMICS SIMULATION; PEPTIDES; RETINOL-BINDING PROTEINS; SOLVENTS; TIME FACTORS; WATER;

EID: 79955665555     PISSN: 01757571     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00249-010-0638-3     Document Type: Article

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