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Material Type: Artigo
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admetSAR: A Comprehensive Source and Free Tool for Assessment of Chemical ADMET PropertiesCheng, Feixiong ; Li, Weihua ; Zhou, Yadi ; Shen, Jie ; Wu, Zengrui ; Liu, Guixia ; Lee, Philip W ; Tang, YunJournal of chemical information and modeling, 2012-11, Vol.52 (11), p.3099-3105 [Periódico revisado por pares]Washington, DC: American Chemical SocietyTexto completo disponível |
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Material Type: Artigo
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Combining Global and Local Measures for Structure-Based Druggability PredictionsVolkamer, Andrea ; Kuhn, Daniel ; Grombacher, Thomas ; Rippmann, Friedrich ; Rarey, MatthiasJournal of chemical information and modeling, 2012-02, Vol.52 (2), p.360-372 [Periódico revisado por pares]Washington, DC: American Chemical SocietyTexto completo disponível |
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3 |
Material Type: Artigo
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Cancer Cell Membrane-Coated Nanoparticles for Anticancer Vaccination and Drug DeliveryFang, Ronnie H ; Hu, Che-Ming J ; Luk, Brian T ; Gao, Weiwei ; Copp, Jonathan A ; Tai, Yiyin ; O’Connor, Derek E ; Zhang, LiangfangNano letters, 2014-04, Vol.14 (4), p.2181-2188 [Periódico revisado por pares]Washington, DC: American Chemical SocietyTexto completo disponível |
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Material Type: Artigo
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Computational Prediction of Metabolism: Sites, Products, SAR, P450 Enzyme Dynamics, and MechanismsKirchmair, Johannes ; Williamson, Mark J ; Tyzack, Jonathan D ; Tan, Lu ; Bond, Peter J ; Bender, Andreas ; Glen, Robert CJournal of chemical information and modeling, 2012-03, Vol.52 (3), p.617-648 [Periódico revisado por pares]Washington, DC: American Chemical SocietyTexto completo disponível |
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Material Type: Artigo
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Chitosan-based biomaterials for tissue engineeringCroisier, Florence ; Jérôme, ChristineEuropean polymer journal, 2013-04, Vol.49 (4), p.780-792 [Periódico revisado por pares]Kidlington: Elsevier LtdTexto completo disponível |
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6 |
Material Type: Artigo
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Classification in the Presence of Label Noise: A SurveyFrenay, Benoit ; Verleysen, MichelIEEE transaction on neural networks and learning systems, 2014-05, Vol.25 (5), p.845-869New York, NY: IEEETexto completo disponível |
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7 |
Material Type: Artigo
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Deep Architectures and Deep Learning in Chemoinformatics: The Prediction of Aqueous Solubility for Drug-Like MoleculesLusci, Alessandro ; Pollastri, Gianluca ; Baldi, PierreJournal of chemical information and modeling, 2013-07, Vol.53 (7), p.1563-1575 [Periódico revisado por pares]Washington, DC: American Chemical SocietyTexto completo disponível |
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8 |
Material Type: Artigo
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Time-Split Cross-Validation as a Method for Estimating the Goodness of Prospective PredictionSheridan, Robert PJournal of chemical information and modeling, 2013-04, Vol.53 (4), p.783-790 [Periódico revisado por pares]Washington, DC: American Chemical SocietyTexto completo disponível |
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9 |
Material Type: Artigo
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Effective Passivation of Exfoliated Black Phosphorus Transistors against Ambient DegradationWood, Joshua D ; Wells, Spencer A ; Jariwala, Deep ; Chen, Kan-Sheng ; Cho, EunKyung ; Sangwan, Vinod K ; Liu, Xiaolong ; Lauhon, Lincoln J ; Marks, Tobin J ; Hersam, Mark CNano letters, 2014-12, Vol.14 (12), p.6964-6970 [Periódico revisado por pares]Washington, DC: American Chemical SocietyTexto completo disponível |
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10 |
Material Type: Artigo
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TRAVIS - A Free Analyzer and Visualizer for Monte Carlo and Molecular Dynamics TrajectoriesBrehm, Martin ; Kirchner, BarbaraJournal of chemical information and modeling, 2011-08, Vol.51 (8), p.2007-2023 [Periódico revisado por pares]Washington, DC: American Chemical SocietyTexto completo disponível |