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ACS Medicinal Chemistry Letters
|
October 15, 2025
Accelerating Scaffold Hopping in Fourth-Generation Epidermal Growth Factor Receptor Inhibitors via Multilevel Virtual Screening
Zhiqi Sun, Donghui Huo, Jiangyu Guo, et al.
Journal of Computer-Aided Molecular Design
|
August 4, 2004
Linear and nonlinear functions on modeling of aqueous solubility of organic compounds by two structure representation methods
Aixia Yan, Johann Gasteiger, Michael Krug, et al.
European Journal of Medicinal Chemistry
|
July 8, 2008
Explorations into modeling human oral bioavailability
Zhi Wang, Aixia Yan, Qipeng Yuan, et al.
Combinatorial Chemistry & High Throughput Screening
|
January 24, 2012
Classification of acetylcholinesterase inhibitors and decoys by a support vector machine
Kai Wang, Xiaoying Hu, Zhi Wang, et al.
Combinatorial Chemistry & High Throughput Screening
|
November 21, 2014
Classification models of HCV NS3 protease inhibitors based on support vector machine (SVM)
Maolin Wang, Shouyi Xuan, Aixia Yan, et al.
Journal of Chemical Information and Modeling
|
August 17, 2012
Prediction of activity cliffs using support vector machines
Kathrin Heikamp, Xiaoying Hu, Aixia Yan, et al.
Journal of the Royal Society, Interface
|
October 2, 2008
Dynamics of conserved waters in human Hsp90: implications for drug design
Aixia Yan, Guy H Grant, W Graham Richards
International Journal of Molecular Sciences
|
May 19, 2012
Classification of HCV NS5B polymerase inhibitors using support vector machine
Maolin Wang, Kai Wang, Aixia Yan, et al.
Briefings in Bioinformatics
|
June 21, 2021
A comprehensive comparative assessment of 3D molecular similarity tools in ligand-based virtual screening
Zhenla Jiang, Jianrong Xu, Aixia Yan, et al.
ACS Omega
|
December 18, 2018
Classification of HIV-1 Protease Inhibitors by Machine Learning Methods
Yang Li, Yujia Tian, Zijian Qin, et al.
Page
of 8
Search research articles
Search
Showing results (21-30 of 73) with videos related to
Sort By:
Page
of 8
ACS Medicinal Chemistry Letters
|
October 15, 2025
Accelerating Scaffold Hopping in Fourth-Generation Epidermal Growth Factor Receptor Inhibitors via Multilevel Virtual Screening
Zhiqi Sun, Donghui Huo, Jiangyu Guo, et al.
Journal of Computer-Aided Molecular Design
|
August 4, 2004
Linear and nonlinear functions on modeling of aqueous solubility of organic compounds by two structure representation methods
Aixia Yan, Johann Gasteiger, Michael Krug, et al.
European Journal of Medicinal Chemistry
|
July 8, 2008
Explorations into modeling human oral bioavailability
Zhi Wang, Aixia Yan, Qipeng Yuan, et al.
Combinatorial Chemistry & High Throughput Screening
|
January 24, 2012
Classification of acetylcholinesterase inhibitors and decoys by a support vector machine
Kai Wang, Xiaoying Hu, Zhi Wang, et al.
Combinatorial Chemistry & High Throughput Screening
|
November 21, 2014
Classification models of HCV NS3 protease inhibitors based on support vector machine (SVM)
Maolin Wang, Shouyi Xuan, Aixia Yan, et al.
Journal of Chemical Information and Modeling
|
August 17, 2012
Prediction of activity cliffs using support vector machines
Kathrin Heikamp, Xiaoying Hu, Aixia Yan, et al.
Journal of the Royal Society, Interface
|
October 2, 2008
Dynamics of conserved waters in human Hsp90: implications for drug design
Aixia Yan, Guy H Grant, W Graham Richards
International Journal of Molecular Sciences
|
May 19, 2012
Classification of HCV NS5B polymerase inhibitors using support vector machine
Maolin Wang, Kai Wang, Aixia Yan, et al.
Briefings in Bioinformatics
|
June 21, 2021
A comprehensive comparative assessment of 3D molecular similarity tools in ligand-based virtual screening
Zhenla Jiang, Jianrong Xu, Aixia Yan, et al.
ACS Omega
|
December 18, 2018
Classification of HIV-1 Protease Inhibitors by Machine Learning Methods
Yang Li, Yujia Tian, Zijian Qin, et al.
Page
of 8