Comparative performance assessment of the conformational model generators omega and catalyst: A large-scale survey on the retrieval of protein-bound ligand conformations

Journal of Chemical Information and Modeling

Volumn 46, Issue 4, 2006, Pages 1848-1861

  Kirchmair, Johannes ^a   Wolber, Gerhard ^b   Laggner, Christian ^a   Langer, Thierry ^a,b  

^a UNIVERSITY OF INNSBRUCK   (Austria)

^b Inte:Ligand Softwareentwicklung und Consulting GmbH   (Austria)

Author keywords

[No Author keywords available]

Indexed keywords

ALGORITHMS; CONFORMATIONS; DATABASE SYSTEMS; MOLECULAR STRUCTURE; PHARMACODYNAMICS; PROTEINS;

BIOACTIVE CONFORMATIONS; DRUG MOLECULES; HIGH-THROUGHPUT SETTINGS; PROTEIN DATA BANK (PDB);

CATALYSTS;

LIGAND; PROTEIN;

ARTICLE; CATALYSIS; CHEMISTRY; COMPARATIVE STUDY; METABOLISM; PROTEIN CONFORMATION;

CATALYSIS; LIGANDS; PROTEIN CONFORMATION; PROTEINS;

EID: 33746921247     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci060084g     Document Type: Article

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