Search Result "ECFP_4"


Research Article

In Silico Prediction of Chemical Toxicity Profile Using Local Lazy Learning

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 20 Issue: 4 Year: 2017 Page: 346-353
Author(s): Jing Lu,Pin Zhang,Xiao-Wen Zou,Xiao-Qiang Zhao,Ke-Guang Cheng,Yi-Lei Zhao,Yi Bi,Ming-Yue Zheng,Xiao-Min Luo

Discrimination of Active and Weakly Active Human BACE1 Inhibitors Using Self-Organizing Map and Support Vector Machine

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 19 Issue: 6 Year: 2016 Page: 470-480
Author(s): Hang Li,Maolin Wang,Ya-Nan Gong,Aixia Yan

Classification Models of HCV NS3 Protease Inhibitors Based on Support Vector Machine (SVM)

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 18 Issue: 1 Year: 2015 Page: 24-32
Author(s): Maolin Wang,Shouyi Xuan,Aixia Yan,Changyuan Yu

Research Article

Identification of Essential 2D and 3D Chemical Features for Discovery of the Novel Tubulin Polymerization Inhibitors

Journal: Current Topics in Medicinal Chemistry
Volume: 19 Issue: 13 Year: 2019 Page: 1092-1120
Author(s): Fateme Azimi,Jahan B. Ghasemi,Lotfollah Saghaei,Farshid Hassanzadeh,Mohammad Mahdavi,Hojjat Sadeghi-Aliabadi,Marcus T. Scotti,Luciana Scotti

Research Article

Predicting Drug Side Effects with Compact Integration of Heterogeneous Networks

Journal: Current Bioinformatics
Volume: 14 Issue: 8 Year: 2019 Page: 709-720
Author(s): Xian Zhao,Lei Chen,Zi-Han Guo,Tao Liu

Systematic Comparison of the Performance of Different 2D and 3D Ligand-Based Virtual Screening Methodologies to Discover Anticonvulsant Drugs

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 18 Issue: 4 Year: 2015 Page: 387-398
Author(s):

Drug-Likeness and Increased Hydrophobicity of Commercially Available Compound Libraries for Drug Screening

Journal: Current Topics in Medicinal Chemistry
Volume: 12 Issue: 14 Year: 2012 Page: 1500-1513
Author(s): Johannes Zuegg,Matthew A. Cooper

In Silico Prediction of Drug Properties

Journal: Current Medicinal Chemistry
Volume: 16 Issue: 2 Year: 2009 Page: 189-202
Author(s): M. C. Hutter

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