Rational selection of training and test sets for the development of validated QSAR models von Golbraikh, Alexander, Shen, Min, Xiao, Zhiyan, Xiao, Yun-De, Lee, Kuo-Hsiung, Tropsha, Alexander

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Worst-Case Identification of Errors-in-Variables Models in Closed Loop von Geng, Li-Hui, Xiao, De-Yun, Zhang, Tao, Song, Jing-Yan

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Combinatorial QSAR of Ambergris Fragrance Compounds von Kovatcheva, Assia, Golbraikh, Alexander, Oloff, Scott, Xiao, Yun-De, Zheng, Weifan, Wolschann, Peter, Buchbauer, Gerhard, Tropsha, Alexander

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Fault diagnosis using pattern classification based on one-dimensional adaptive rank-order morphological filter von Li, Han, Xiao, De-yun

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Fault diagnosis based on power spectral density basis transform von Li, Han, Xiao, De-yun

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Morphological filtering assisted field-pipeline small leakage detection von Han Li, De-Yun Xiao, Xiang Zhao

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Fault diagnosis of Tennessee Eastman process using signal geometry matching technique von Li, Han, Xiao, De-yun

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Supervised Self-Organizing Maps in Drug Discovery. 2. Improvements in Descriptor Selection and Model Validation von Xiao, Yun-De, Harris, Rebecca, Bayram, Ersin, Santago, Peter, Schmitt, Jeffrey D

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Discovery of 3‑(5-Chloro-2-furoyl)-3,7-diazabicyclo[3.3.0]octane (TC-6683, AZD1446), a Novel Highly Selective α4β2 Nicotinic Acetylcholine Receptor Agonist for the Treatment of Cog... von Mazurov, Anatoly A, Miao, Lan, Bhatti, Balwinder S, Strachan, Jon-Paul, Akireddy, Srinivasa, Murthy, Srinivasa, Kombo, David, Xiao, Yun-de, Hammond, Philip, Zhang, Jenny, Hauser, Terry A, Jordan, Kristen G, Miller, Craig H, Speake, Jason D, Gatto, Gregory J, Yohannes, Daniel

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Antitumor Agents. 213. † Modeling of Epipodophyllotoxin Derivatives Using Variable Selection k Nearest Neighbor QSAR Method von Xiao, Zhiyan, Xiao, Yun-De, Feng, Jun, Golbraikh, Alexander, Tropsha, Alexander, Lee, Kuo-Hsiung

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Analgesic effects mediated by neuronal nicotinic acetylcholine receptor agonists: Correlation with desensitization of α4β2 receptors von Zhang, Jiahui, Xiao, Yun-De, Jordan, Kristen G., Hammond, Phil S., Van Dyke, Katherine M., Mazurov, Anatoly A., Speake, Jason D., Lippiello, Patrick M., James, John W., Letchworth, Sharon R., Bencherif, Merouane, Hauser, Terry A.

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Supervised Self-Organizing Maps in Drug Discovery. 1. Robust Behavior with Overdetermined Data Sets von Xiao, Yun-De, Clauset, Aaron, Harris, Rebecca, Bayram, Ersin, Santago, Peter, Schmitt, Jeffrey D

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Attitude-control model identification of on-orbit satellites actuated by reaction wheels von Geng, Li-Hui, Xiao, De-Yun, Wang, Qian, Zhang, Tao, Song, Jing-Yan

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Quantitative structure–activity relationships of methotrexate and methotrexate analogues transported by the rat multispecific resistance-associated protein 2 (rMrp2) von Ng, Chee, Xiao, Yun-De, Lum, Bert L., Han, Yong-Hae

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Modeling of p38 mitogen-activated protein kinase inhibitors using the Catalyst™ HypoGen and k-nearest neighbor QSAR methods von Xiao, Zhiyan, Varma, Shikha, Xiao, Yun-De, Tropsha, Alexander

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Collision and transport properties of Rg+Cl(2P) and Rg+Cl−(1S) (Rg=Ar, Kr) from ab initio potentials von Buchachenko, A. A., Krems, R. V., Szczȩśniak, M. M., Xiao, Yun-De, Viehland, Larry A., Chałasiński, Grzegorz

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Genetic algorithms and self-organizing maps: a powerful combination for modeling complex QSAR and QSPR problems von Bayram, Ersin, Santago, 2nd, Peter, Harris, Rebecca, Xiao, Yun-De, Clauset, Aaron J, Schmitt, Jeffrey D

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Targacept Active Conformation Search:  A New Method for Predicting the Conformation of a Ligand Bound to Its Protein Target von Klucik, Josef, Xiao, Yun-De, Hammond, Phillip S, Harris, Rebecca, Schmitt, Jeffrey D

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Trend extraction based on variable time window length median filter von Han Li, De-yun Xiao, Xiang Zhao

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Real-time traffic management under emergency evacuation based on dynamic traffic assignment von Yue-ming Chen, De-yun Xiao

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