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huqionghhkk木虫 (小有名气)
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[求助]
求助有机化学翻译一小段
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We recently analyzed a large compound collection in 100 parallel protein-binding assays (48) and found both proteinbinding frequencies and specificities are increased among compounds having intermediate stereochemical complexity. Here,we extend analysis of the same compounds to physicochemical properties (6, 7, 16, 54) and shape-based descriptors (27, 29), revealing additional similarities and differences between sets. We use principal component analysis (PCA) (55) of chemically intuitive properties to analyze sources of variation among the sets. Different descriptors report different aspects of chemical structure (36), and we aim to illustrate for synthetic chemists how quantitative relationships can be reconciled with chemical intuition. |
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8814402
至尊木虫 (职业作家)
- 翻译EPI: 509
- 应助: 18 (小学生)
- 贵宾: 0.381
- 金币: 12916.1
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- 虫号: 1184404
- 注册: 2011-01-06
- 专业: 药物学其他科学问题
【答案】应助回帖
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sltmac(金币+2): 感谢应助~ 2011-06-29 18:17:51
sltmac(金币+15): 欢迎常来~ 2011-07-02 10:06:27
sltmac(金币+2): 感谢应助~ 2011-06-29 18:17:51
sltmac(金币+15): 欢迎常来~ 2011-07-02 10:06:27
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We recently analyzed a large compound collection in 100 parallel protein-binding assays (48) and found both proteinbinding frequencies and specificities are increased among compounds having intermediate stereochemical complexity. 我们近来以100种平行蛋白结合测试分析了一系列化合物，发现在具有中等立体结构复杂性的化合物中蛋白结合频次和特异性增加。Here,we extend analysis of the same compounds to physicochemical properties (6, 7, 16, 54) and shape-based descriptors (27, 29), revealing additional similarities and differences between sets.这里，我们将对这些化合物的分析扩展到其物理化学特性和基于现状的描述符，以揭示化合物集合间更多的相似性和差异。 We use principal component analysis (PCA) (55) of chemically intuitive properties to analyze sources of variation among the sets. 我们使用化学直观特性的主成分分析来确定集合间变异来源。Different descriptors report different aspects of chemical structure (36), and we aim to illustrate for synthetic chemists how quantitative relationships can be reconciled with chemical intuition.不同的描述符描述化合物结构的不同方面，我们的目标是为合成化学家说明如何使定量关系与化学直觉相一致。 |
2楼2011-06-29 14:35:33
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