Bioinformatics based ligand-docking and in-silico screening

Chemical and Pharmaceutical Bulletin

Volumn 56, Issue 5, 2008, Pages 742-744

  Takaya, Daisuke ^a   Takeda Shitaka, Mayuko ^a   Terashi, Genki ^a   Kanou, Kazuhiko ^a   Iwadate, Mitsuo ^a   Umeyama, Hideaki ^a  

^a KITASATO UNIVERSITY   (Japan)

Author keywords

CHOOse biological information semi empirically on the ligand docking; Fingerprint; Flexible docking; In silico screening; Simulated annealing; Tanimoto coefficient

Indexed keywords

ARTICLE; BIOINFORMATICS; CALCULATION; COMPUTER MODEL; DRUG TARGETING; FINGER DERMATOGLYPHICS; MONTE CARLO METHOD; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY;

ALGORITHMS; COMPUTATIONAL BIOLOGY; COMPUTER SIMULATION; DNA FINGERPRINTING; DRUG EVALUATION, PRECLINICAL; LIGANDS; MODELS, GENETIC; MODELS, STATISTICAL; PROTEIN BINDING;

EID: 43449126836     PISSN: 00092363     EISSN: 13475223     Source Type: Journal    
DOI: 10.1248/cpb.56.742     Document Type: Article

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