DEVELOPMENT OF AN EFFICIENT AUTOMATED DOCKING METHOD
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概要
- 論文の詳細を見る
An efficient automated method of searching for stable docking structures of protein-ligand complex has been developed. The method outputs several promising docking models in which protein and ligand interact favorably, covering all possible binding modes and ligand conformations. Our search method is excellent in terms of not only ease of use and speed of calculation, but also reliability and reproducibility of the docking results. It should become an indispensable tool for investigating biochemical reaction processes and designing new drug structures based on receptor structure.
- 公益社団法人日本薬学会の論文
- 1993-06-15
著者
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板井 昭子
Faculty of Pharmaceutical Science, University of Tokyo
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山田 実穂
Faculty of Pharmaceutical Sciences, University of Tokyo
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山田 実穂
Faculty Of Pharmaceutical Sciences University Of Tokyo
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板井 昭子
Faculty Of Pharmaceutical Sciences University Of Tokyo
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