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Catalytic Site Prediction and Virtual Screening of Cytochrome P450 2D6 Substrates by Consideration of Water and Rescoring in Automated Docking

机译：通过考虑水分对接的催化部位预测和细胞色素P450 2D6基板的虚拟筛选

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1. Catalytic site prediction and virtual screening of cytochrome P450 2D6 substrates by consideration of water and rescoring in automated docking [J] . de Graaf C, Oostenbrink C, Keizers PHJ, Journal of Medicinal Chemistry . 2006,第8期

机译：考虑水和自动对接中的记录，对细胞色素P450 2D6底物的催化位点预测和虚拟筛选
2. Binding Mode Prediction of Cytochrome P450 and Thymidine Kinase Protein-Ligand Complexes by Consideration of Water and Rescoring in Automated Docking. [J] . de Graaf C, Pos W, Vermeulen NP Journal of Medicinal Chemistry . 2005,第7期

机译：考虑到水和自动对接的记录，预测细胞色素P450和胸苷激酶蛋白配体的结合模式。
3. Computational predictions of the site of metabolism of cytochrome P450 2D6 substrates: comparative analysis, molecular docking, bioactivation and toxicological implications [J] . Ford Kevin A., Ryslik Gregory, Sodhi Jasleen, Drug Metabolism Reviews . 2015,第1a4期

机译：细胞色素P450 2D6底物代谢位点的计算预测：比较分析，分子对接，生物活化和毒理学意义
4. Virtual screening of cytochrome P450 2A6 inhibitors from traditional Chinese medicine using support vector machine and molecular docking [C] . Ganggang Luo, Fang Lu, Ludi Jiang, International Conference on BioMedical Engineering and Informatics . 2015

机译：支持向量机和分子对接技术从中药中虚拟筛选细胞色素P450 2A6抑制剂
5. Docking and cheminformatic analysis of protein-ligand interactions: Cytochromes P450 (2D6 and P450cam) and estrogen receptors from human and zebrafish. [D] . Costache, Aurora Demetrina. 2006

机译：蛋白质-配体相互作用的对接和化学信息学分析：人类和斑马鱼的细胞色素P450（2D6和P450cam）和雌激素受体。
6. Ligand-Based Site of MetabolismPrediction for Cytochrome P450 2D6 [O] . Patrik Rydberg, *, Lars Olsen 2012

机译：基于配体的代谢位点细胞色素P450 2D6的预测
7. Binding mode prediction of cytochrome p450 and thymidine kinase protein-ligand complexes by consideration of water and rescoring in automated docking [O] . de Graaf C., Pospisil P., Pos W., 2005

机译：考虑水和自动对接的预测细胞色素p450和胸苷激酶蛋白-配体复合物的结合模式预测

Catalytic Site Prediction and Virtual Screening of Cytochrome P450 2D6 Substrates by Consideration of Water and Rescoring in Automated Docking

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