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A Comprehensive Comparison of Ligand-Based Virtual Screening Tools Against the DUD Dataset Reveals Limitations of Current 3D Methods

机译：基于配体的虚拟筛选工具与DUD数据集的综合比较揭示了当前3D方法的局限性

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Vishwesh Venkatraman; Violeta I. Pérez-nueno; Lazaros Mavridis; David W. Ritchie;
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年度 2011
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1. Comprehensive comparison of ligand-based virtual screening tools against the DUD data set reveals limitations of current 3D methods [J] . Venkatraman V., Pérez-Nueno V.I., Mavridis L., Journal of chemical information and modeling . 2010,第12期

机译：基于配体的虚拟筛选工具与DUD数据集的全面比较揭示了当前3D方法的局限性
2. Systematic Comparison of the Performance of Different 2D and 3D Ligand-Based Virtual Screening Methodologies to Discover Anticonvulsant Drugs [J] . Di Ianni Mauricio E., Gantner Melisa E., Ruiz Maria E., Combinatorial chemistry & high throughput screening . 2015,第4期

机译：对基于2D和3D配体的不同虚拟筛选方法发现抗惊厥药物的性能进行系统比较
3. Current trends in virtual high throughput screening using ligand-based and structure-based methods. [J] . Sukumar N, Das S Combinatorial chemistry & high throughput screening . 2011,第10期

机译：使用基于配体和基于结构的方法进行虚拟高通量筛选的当前趋势。
4. Deep Belief Network for Molecular Feature Selection in Ligand-Based Virtual Screening [C] . Maged Nasser, Naomie Salim, Hentabli Hamza, International Coference of Reliable Information and Communication Technology . 2019

机译：基于配体的虚拟筛选中分子特征选择的深度信仰网络
5. Automation and Expansion of the Metagenomics Analysis Methodology Using Computational Tools and Statistical Methods to Support Small High-Dimensional Datasets [D] . Hopson, Lindsay M. 2021

机译：使用计算工具和统计方法来支持小型高维数据集的自动化和扩展方法
6. Hidden bias in the DUD-E dataset leads to misleading performance of deep learning in structure-based virtual screening [O] . Lieyang Chen, Anthony Cruz, Steven Ramsey, 2012

机译：DUD-E数据集中的隐藏偏见导致在基于结构的虚拟筛选中深度学习的误导性表现
7. Comprehensive Comparison of Ligand-Based Virtual Screening Tools Against the DUD Data set Reveals Limitations of Current 3D Methods [O] . Venkatraman, Vishwesh, Perez-Nueno, Violeta I., Mavridis, Lazaros, 2010

机译：基于配体的虚拟筛选工具与DUD数据集的全面比较揭示了当前3D方法的局限性

A Comprehensive Comparison of Ligand-Based Virtual Screening Tools Against the DUD Dataset Reveals Limitations of Current 3D Methods

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