Docking studies on DNA-ligand interactions: Building and application of a protocol to identify the binding mode

Journal of Chemical Information and Modeling

Volumn 49, Issue 8, 2009, Pages 1925-1935

  Ricci, Clarisse G ^a   Netz, Paulo A ^a  

^a FEDERAL UNIVERSITY OF RIO GRANDE DO SUL   (Brazil)

Author keywords

[No Author keywords available]

Indexed keywords

BINDING ENERGY; DNA; DOCKS; HYDRAULIC STRUCTURES; LIGANDS; MOLECULAR DYNAMICS;

DNA-BINDING MODES; DNA-LIGAND INTERACTIONS; DOCKING PROGRAMS; DOCKING STUDIES; INTERCALATORS; MINOR GROOVES; MOLECULAR DYNAMICS SIMULATIONS; THEORETICAL STUDY;

BIOINFORMATICS;

ACRIDINE DERIVATIVE; AFLATOXIN B1; AFLATOXIN B1 2,3 OXIDE; AFLATOXIN B1-2,3-OXIDE; CONGOCIDINE; DNA; DRUG DERIVATIVE; ELLIPTICINE; ELLIPTICINE DERIVATIVE; LIGAND;

ARTICLE; BINDING SITE; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; CONFORMATION; METABOLISM; X RAY CRYSTALLOGRAPHY;

ACRIDINES; AFLATOXIN B1; BINDING SITES; COMPUTER SIMULATION; CRYSTALLOGRAPHY, X-RAY; DNA; ELLIPTICINES; LIGANDS; MODELS, MOLECULAR; NETROPSIN; NUCLEIC ACID CONFORMATION;

EID: 69549090094     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci9001537     Document Type: Article

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