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Sheng-Yong Yang
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2020 – today
- 2024
- [j16]Yuanyuan Jiang, Guo Zhang, Jing You, Hailin Zhang
, Rui Yao, Huan-Zhang Xie, Liyun Zhang, Ziyi Xia, Mengzhe Dai, Yunjie Wu, Linli Li, Sheng-Yong Yang
PocketFlow is a data-and-knowledge-driven structure-based molecular generative model. Nat. Mac. Intell. 6(3): 326-337 (2024) - 2022
- [j15]Xin Yang, Guifeng Lin
Discovery of Small Molecule Agonist of Gonadotropin-Releasing Hormone Receptor (GnRH1R). J. Chem. Inf. Model. 62(20): 5009-5022 (2022)
2010 – 2019
- 2017
- [j14]Feixiong Cheng, Huixiao Hong
Individualized network-based drug repositioning infrastructure for precision oncology in the panomics era. Briefings Bioinform. 18(4): 682-697 (2017) - [j13]Xian Zeng
HEROD: a human ethnic and regional specific omics database. Bioinform. 33(20): 3276-3282 (2017) - [j12]Shenzhen Huang
Discovery of New SIRT2 Inhibitors by Utilizing a Consensus Docking/Scoring Strategy and Structure-Activity Relationship Analysis. J. Chem. Inf. Model. 57(4): 669-679 (2017) - [j11]Guo-Bo Li
IFPTarget: A Customized Virtual Target Identification Method Based on Protein-Ligand Interaction Fingerprinting Analyses. J. Chem. Inf. Model. 57(7): 1640-1651 (2017) - 2015
- [j10]Cheng Zhang, Lin Tao, Chu Qin, Peng Zhang, Shangying Chen, Xian Zeng, Feng Xu, Zhe Chen, Sheng-Yong Yang, Yuzong Chen:
CFam: a chemical families database based on iterative selection of functional seeds and seed-directed compound clustering. Nucleic Acids Res. 43(Database-Issue): 558-565 (2015) - 2014
- [j9]Shu Zhou, Guo-Bo Li
A prediction model of drug-induced ototoxicity developed by an optimal support vector machine (SVM) method. Comput. Biol. Medicine 51: 122-127 (2014) - [j8]Chu Qin, Cheng Zhang, Feng Zhu, Feng Xu, Shangying Chen, Peng Zhang, Ying Hong Li, Sheng-Yong Yang, Yu-Quan Wei, Lin Tao, Yuzong Chen:
Therapeutic target database update 2014: a resource for targeted therapeutics. Nucleic Acids Res. 42(Database-Issue): 1118-1123 (2014) - 2013
- [j7]Guo-Bo Li
ID-Score: A New Empirical Scoring Function Based on a Comprehensive Set of Descriptors Related to Protein-Ligand Interactions. J. Chem. Inf. Model. 53(3): 592-600 (2013) - 2011
- [j6]Lei Zhong
A prediction model of substrates and non-substrates of breast cancer resistance protein (BCRP) developed by GA-CG-SVM method. Comput. Biol. Medicine 41(11): 1006-1013 (2011) - [j5]Pankaj Kumar, Xiao Hua Ma, Xianghui Liu, Jia Jia, Bu-Cong Han, Ying Xue
Effect of training data size and noise level on support vector machines virtual screening of genotoxic compounds from large compound libraries. J. Comput. Aided Mol. Des. 25(5): 455-467 (2011) - [j4]Ji-Xia Ren, Lin-Li Li, Ren-Lin Zheng, Huan-Zhang Xie, Zhi-Xing Cao, Shan Feng, You-Li Pan, Xin Chen, Yu-Quan Wei, Sheng-Yong Yang:
Discovery of Novel Pim-1 Kinase Inhibitors by a Hierarchical Multistage Virtual Screening Approach Based on SVM Model, Pharmacophore, and Molecular Docking. J. Chem. Inf. Model. 51(6): 1364-1375 (2011) - [j3]Qi Huang, Lin-Li Li, Sheng-Yong Yang:
RASA: A Rapid Retrosynthesis-Based Scoring Method for the Assessment of Synthetic Accessibility of Drug-like Molecules. J. Chem. Inf. Model. 51(10): 2768-2777 (2011)
2000 – 2009
- 2009
- [j2]Sheng-Yong Yang, Qi Huang, Lin-Li Li, Chang-Ying Ma, Hui Zhang, Ru Bai, Qizhi Teng, Ming-Li Xiang, Yu-Quan Wei:
An integrated scheme for feature selection and parameter setting in the support vector machine modeling and its application to the prediction of pharmacokinetic properties of drugs. Artif. Intell. Medicine 46(2): 155-163 (2009) - 2007
- [j1]Sheng-Yong Yang, Ming-Li Xiang, Li-Juan Chen, Guo-Bin Xie, Bing Shi, Yu-Quan Wei
Free energy profiles for monomer capture in Grubbs- and SHOP-type olefin polymerization catalysts: A constraint ab initio molecular dynamics study. J. Comput. Chem. 28(2): 513-518 (2007)
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