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Study of the Docking of Competitive Inhibitors at a Model of Tyrosinase Active Site: Insights from Joint Broken-Symmetry/ Spin-Flip DFT Computations and ELF Topological Analysis

机译：酪氨酸酶活性位点模型中竞争抑制剂的对接研究：联合断裂 - 对称/自旋翻转DFT计算和ELF拓扑分析的见解

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A. De La Lande; J. Maddaluno; O. Parisel; T. A. Darden; J-p Piquemal;
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1. Study of the Docking of Competitive Inhibitors at a Model of Tyrosinase Active Site: Insights from Joint Broken-Symmetry/Spin-Flip DFT Computations and ELF Topological Analysis [J] . A. de la LANDE, J. MADDALUNO, O. PARISEL, Interdisciplinary Sciences: Computational Life Sciences . 2010,第1期

机译：酪氨酸酶活性位点模型上的竞争性抑制剂对接研究：联合断裂对称/自旋翻转DFT计算和ELF拓扑分析的见解
2. A new insight into mushroom tyrosinase inhibitors: docking, pharmacophore-based virtual screening, and molecular modeling studies [J] . Bagherzadeh Kowsar, Talari Faezeh Shirgahi, Sharifi Amirhossein, Journal of Biomolecular Structure and Dynamics . 2015,第3a4期

机译：蘑菇酪氨酸酶抑制剂的新见解：对接，基于药效团的虚拟筛选和分子建模研究
3. Theoretical study of phenol and 2-aminophenol docking at a model of the tyrosinase active site [J] . Piquemal JP., Maddaluno J., Silvi B., New Journal of Chemistry . 2003,第6期

机译：苯酚和2-氨基苯酚在酪氨酸酶活性位点模型上对接的理论研究
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5. Combination of the Computational Methods: Molecular dynamics, Homology Modeling and Docking to Design Novel Inhibitors and Study Structural Changes in Target Proteins for Current Diseases. [D] . Parra, Katherine. 2014

机译：计算方法的组合：分子动力学，同源性建模和对接，以设计新型抑制剂并研究当前疾病靶蛋白的结构变化。
6. Study of the docking of competitive inhibitors at a model of tyrosinase active site: insights from joint broken-symmetry/Spin-Flip DFT computations and ELF topological analysis [O] . A. de la Lande, J. Maddaluno, O. Parisel, -1

机译：竞争性抑制剂对酪氨酸酶活性位点模型的对接：关节破碎/旋转DFT计算和ELF拓扑分析的见解
7. Novel biphenyl ester derivatives as tyrosinase inhibitors: Synthesis, crystallographic, spectral analysis and molecular docking studies. [O] . Huey Chong Kwong, C S Chidan Kumar, Siau Hui Mah, 2017

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Study of the Docking of Competitive Inhibitors at a Model of Tyrosinase Active Site: Insights from Joint Broken-Symmetry/ Spin-Flip DFT Computations and ELF Topological Analysis

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